SCHEMBL1397681

SCHEMBL1397681

Clc1cc(Br)c2[nH]ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A1 P68400 1/20 0.46
▸ AHR P35869 5/20 0.45
▸ NR4A2 P43354 2/20 0.45
▸ F7 P08709 1/20 0.45
▸ LTA4H P09960 1/20 0.45
▸ F3 P13726 1/20 0.45
▸ TNF P01375 1/20 0.42
▸ RIPK1 Q13546 1/20 0.42
▸ CMA1 P23946 1/20 0.41
▸ IKBKB O14920 3/20 0.38
▸ CHUK O15111 2/20 0.38
▸ CHEK1 O14757 1/20 0.37
▸ CYP2A6 P11509 1/20 0.36
▸ PIM3 Q86V86 1/20 0.34
▸ NR3C1 P04150 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ GRM5 P41594 1/20 0.33
▸ CCR8 P51685 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ DYRK1A Q13627 1/20 0.31

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
SCHEMBL838245 0.78 AHR (0.54) CSNK2A1AHRNR4A2F7LTA4H
SCHEMBL8995163 0.78 AHR (0.48) CSNK2A1AHRNR4A2F7LTA4H
SCHEMBL21315701 0.78 AHR (0.48) CSNK2A1AHRNR4A2F7LTA4H
SCHEMBL28870331 0.77 CHEK1 (0.51) CSNK2A1AHRNR4A2F7LTA4H
SCHEMBL34460066 0.77 CSNK2A1 (0.38) CSNK2A1AHRNR4A2TNFRIPK1
SCHEMBL1137858 0.77 AHR (0.47) CSNK2A1AHRNR4A2TNFRIPK1
SCHEMBL13961694 0.75 AHR (0.45) CSNK2A1AHRNR4A2F7LTA4H
SCHEMBL14909105 0.75 TNF (0.57) CSNK2A1AHRNR4A2F7LTA4H
SCHEMBL28600170 0.75 AHR (0.45) CSNK2A1AHRNR4A2F7LTA4H
SCHEMBL2599709 0.75 AHR (0.45) AHRNR4A2F7LTA4HF3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4712969-A1 CYCLIN INHIBITORS Circle Pharma, Inc. (US) 2026-03-25 — — EP disclosed
EP-4650345-A1 HETEROCYCLIC COMPOUND AND USE THEREOF IN MEDICINE Kangbaida (Sichuan) Biotechnology Co., Ltd. (CN) 2025-11-19 — — EP disclosed
US-12448368-B2 Indole compounds as androgen receptor modulators NIDO BIOSCIENCES, INC. (US) 2025-10-21 — — US disclosed
US-12428421-B2 Pyrimidinones as factor XIA inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2025-09-30 — — 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-12240812-B2 Compound for inhibiting PGE2/EP4 signaling transduction inhibiting, preparation method therefor, and medical uses thereof Keythera (Suzhou) Pharmaceuticals Co. Ltd. (CN) 2025-03-04 — — US disclosed
US-20240408169-A1 CYCLIN INHIBITORS CIRCLE PHARMA, INC. 2024-12-12 — — US disclosed
EP-3889134-B1 COMPOUND FOR INHIBITING PGE2/EP4 SIGNALING TRANSDUCTION INHIBITING, PREPARATION METHOD THEREFOR, AND MEDICAL USES THEREOF KEYTHERA SUZHOU PHARMACEUTICALS CO LTD (CN) 2024-09-25 — — EP disclosed
WO-2024130095-A9 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-08-02 — — WO disclosed
US-20070254917-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INC. 2007-11-01 — — US disclosed
US-7259183-B2 Indole, indazole and indoline derivatives as CETP inhibitors HOFFMANN-LA ROCHE INC. (US) 2007-08-21 — — US disclosed
CN-101018552-A Intracellular receptor modulator compounds and methods LIGAND PHARM INC (US) 2007-08-15 — — CN disclosed
US-20070185113-A1 Heteroaryl and benzyl amide compounds HOFFMANN-LA ROCHE INC. 2007-08-09 — — US disclosed
CN-1993323-A Indole, indazole or indoline derivatives HOFFMANN LA ROCHE (CH) 2007-07-04 — — CN disclosed
EP-1778233-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 2007-05-02 — — EP disclosed
EP-1776338-A1 INDOLE, INDAZOLE OR INDOLINE DERIVATIVES F. Hoffmann-Roche AG (CH) 2007-04-25 — — EP disclosed
WO-2006019716-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 2006-02-23 — — WO disclosed
US-20060030613-A1 Indole, indazole and indoline derivatives as CETP inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2006-02-09 — — US disclosed
WO-2006013048-A1 INDOLE, INDAZOLE OR INDOLINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2006-02-09 — — 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 (9 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-20060030613-A1 Indole, indazole and indoline derivatives as CETP inhibitors CETP, NAT1, MTTP CSNK2A1 620/4885AHR 596/4885NR4A2 2861/4885
US-12428421-B2 Pyrimidinones as factor XIA inhibitors TFPI, TFPI2, F2 CSNK2A1 530/4885AHR 3035/4885NR4A2 4260/4885
US-20070254917-A1 INTRACELLULAR RECEPTOR MODULATOR COMPOUNDS AND METHODS CASR, GRK2, RYR2 CSNK2A1 951/4885AHR 1370/4885NR4A2 402/4885
US-20250122176-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 CSNK2A1 1039/4885AHR 195/4885NR4A2 124/4885
US-20240408169-A1 CYCLIN INHIBITORS CCNI, CDK2, CDK1 CSNK2A1 115/4885AHR 2299/4885NR4A2 1529/4885
US-20070185113-A1 Heteroaryl and benzyl amide compounds CYP2C19, CYP2C9, CYP3A43 CSNK2A1 365/4885AHR 145/4885NR4A2 2766/4885
US-20250092021-A9 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 CSNK2A1 1039/4885AHR 195/4885NR4A2 124/4885
US-12448368-B2 Indole compounds as androgen receptor modulators AR, FSHR, ADRB3 CSNK2A1 1276/4885AHR 174/4885NR4A2 139/4885
US-12240812-B2 Compound for inhibiting PGE2/EP4 signaling transduction inhibiting, preparation method therefor, and medical uses thereof PTGER4, PTGER1, PTGES CSNK2A1 4182/4885AHR 469/4885NR4A2 1520/4885

“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.

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