SCHEMBL335171

SCHEMBL335171

Brc1cnc2cccnc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
ALDH1A1 P00352 4/20 0.43
DYRK1A Q13627 2/20 0.39
KDM4E B2RXH2 3/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
BIRC5 O15392 1/20 0.37
KMT2A Q03164 2/20 0.35
CASP1 P29466 2/20 0.35
MEN1 O00255 1/20 0.35
CASP7 P55210 1/20 0.35
NR4A2 P43354 1/20 0.35
TP53 P04637 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
TSHR P16473 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29796470 1.00 HTT (0.53) HTTCYP1A2CYP2C19ALDH1A1DYRK1A
SCHEMBL29470857 0.81 DYRK1A (0.52) HTTCYP1A2CYP2C19ALDH1A1DYRK1A
SCHEMBL934055 0.81 DYRK1A (0.52) HTTCYP1A2CYP2C19ALDH1A1DYRK1A
Quinoline SCHEMBL28218277 0.80 ALDH1A1 (0.63) HTTCYP1A2CYP2C19ALDH1A1KDM4E
SCHEMBL25195755 0.78 KDM4E (0.61) HTTCYP1A2CYP2C19KDM4EMAPT
SCHEMBL274826 0.76 ALDH1A1 (0.44) HTTCYP1A2CYP2C19ALDH1A1KDM4E
SCHEMBL8194 0.75 ALDH1A1 (0.67) HTTCYP1A2CYP2C19ALDH1A1KDM4E
SCHEMBL30099834 0.75 ALDH1A1 (0.67) HTTCYP1A2CYP2C19ALDH1A1KDM4E
SCHEMBL19445102 0.74 ALDH1A1 (0.43) HTTCYP1A2CYP2C19ALDH1A1KDM4E
SCHEMBL4141544 0.74 BCHE (0.44) HTTCYP1A2CYP2C19ALDH1A1KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 228 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260109698-A1 MALT-1 MODULATORS EXSCIENTIA AI LIMITED (GB) 2026-04-23 US disclosed
US-20260008760-A1 DIPEPTIDYL PEPTIDASE 1 INHIBITORS AND USES THEREOF INSMED INCORPORATED 2026-01-08 US disclosed
US-12448368-B2 Indole compounds as androgen receptor modulators NIDO BIOSCIENCES, INC. (US) 2025-10-21 US disclosed
US-12441726-B2 Compounds and uses thereof FOGHORN THERAPEUTICS, INC. (US) 2025-10-14 US disclosed
US-20250122176-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES INC (US) 2025-04-17 US disclosed
US-20250092021-A9 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. 2025-03-20 US disclosed
US-20250051327-A1 MALT-1 MODULATORS RECURSION PHARMACEUTICALS, INC. 2025-02-13 US disclosed
US-20250011291-A1 KEAP1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2025-01-09 US disclosed
WO-2024258154-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 진웅산업 2024-12-19 WO disclosed
WO-2024258158-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 진웅산업 2024-12-19 WO disclosed
EP-1985620-A1 10a-AZALIDE COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2008-10-29 EP disclosed
WO-2008082487-A2 NOVEL JNK INHIBITORS SCHERING CORPORATION (US) 2008-07-10 WO disclosed
CN-101035780-A Substituted nitrogen-containing six-membered amino-heterocycles as vanilloid-1 receptor antagonists for treating pain MERCK SHARP & DOHME (GB) 2007-09-12 CN disclosed
US-20060148730-A1 Using macrolide and ketolide compound THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2006-07-06 US disclosed
US-20060135447-A1 Macrolides CHUPAK LOUIS S 2006-06-22 US disclosed
US-20050197342-A1 Substituted nitrogen-containing six-membered amino-heterocycles as vanilloid-1 receptor antagonists for treating pain HOLLINGWORTH GREGORY J (GB) 2005-09-08 US disclosed
US-20050014706-A1 Method of treating tuberculosis BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS, THE 2005-01-20 US disclosed
EP-1345953-A2 KETOLIDE ANTIBACTERIALS Ortho-Mcneil Pharmaceutical, Inc. (US) 2003-09-24 EP disclosed
US-6590083-B1 Compounds of given formula; erythromycin derivatives; useful in the treatment of bacterial and protozoal infections and conditions involving gastric motility ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-07-08 US disclosed
WO-2002032918-A2 KETOLIDE ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2002-04-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060148730-A1 Using macrolide and ketolide compound MLYCD, TREH, TKT HTT 3582/4885CYP1A2 2749/4885CYP2C19 1661/4885
US-20050197342-A1 Substituted nitrogen-containing six-membered amino-heterocycles as vanilloid-1 receptor antagonists for treating pain OPRL1, OPRK1, CNR1 HTT 1490/4885CYP1A2 1165/4885CYP2C19 1781/4885
US-20060135447-A1 Macrolides LCAT, NOP2, HDAC6 HTT 123/4885CYP1A2 502/4885CYP2C19 629/4885
US-20250122176-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 HTT 397/4885CYP1A2 2414/4885CYP2C19 2945/4885
US-12441726-B2 Compounds and uses thereof VHL, CLN6, TFEB HTT 234/4885CYP1A2 3256/4885CYP2C19 3974/4885
US-20250011291-A1 KEAP1 INHIBITORS AND USES THEREOF KEAP1, NFE2L2, NQO1 HTT 1273/4885CYP1A2 2686/4885CYP2C19 4054/4885
US-20260008760-A1 DIPEPTIDYL PEPTIDASE 1 INHIBITORS AND USES THEREOF DPP9, DPP7, DPP4 HTT 3592/4885CYP1A2 1328/4885CYP2C19 1109/4885
US-20250092021-A9 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 HTT 397/4885CYP1A2 2414/4885CYP2C19 2945/4885
US-12448368-B2 Indole compounds as androgen receptor modulators AR, FSHR, ADRB3 HTT 278/4885CYP1A2 2366/4885CYP2C19 2594/4885
US-20050014706-A1 Method of treating tuberculosis TREH, TKT, DCXR HTT 3560/4885CYP1A2 1257/4885CYP2C19 1166/4885
US-20250051327-A1 MALT-1 MODULATORS MALT1, BCL6, BCL9 HTT 3492/4885CYP1A2 2312/4885CYP2C19 3333/4885
US-20260109698-A1 MALT-1 MODULATORS MALT1, BCL6, BCL3 HTT 2522/4885CYP1A2 2389/4885CYP2C19 3218/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.