SCHEMBL532001

SCHEMBL532001

COC(=O)c1ccc(N2CCNCC2)nc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.67
KMT2A Q03164 2/20 0.67
NPC1 O15118 1/20 0.67
CRBN Q96SW2 4/20 0.61
DDB1 Q16531 2/20 0.56
HRH3 Q9Y5N1 2/20 0.53
OGA O60502 1/20 0.53
MAPK1 P28482 2/20 0.50
HPGDS O60760 1/20 0.50
KCNH2 Q12809 1/20 0.49
MAPT P10636 1/20 0.49
HDAC2 Q92769 2/20 0.48
HDAC3 O15379 1/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
OPRD1 P41143 1/20 0.47

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
Hydrochloric Acid SCHEMBL19283913 0.99 KMT2A (0.66) RAB9AKMT2ANPC1CRBNDDB1
SCHEMBL5204132 0.95 RAB9A (0.62) RAB9AKMT2ANPC1CRBNDDB1
SCHEMBL3895677 0.87 RAB9A (0.72) RAB9AKMT2ANPC1CRBNDDB1
Hydrochloric Acid SCHEMBL7357024 0.86 RAB9A (0.58) RAB9AKMT2ANPC1CRBNDDB1
SCHEMBL7326778 0.85 RAB9A (0.71) RAB9AKMT2ANPC1CRBNDDB1
SCHEMBL20423547 0.85 CRBN (0.57) RAB9AKMT2ANPC1CRBNDDB1
SCHEMBL386639 0.85 P2RY12 (0.60) RAB9AKMT2ANPC1CRBNHRH3
SCHEMBL1331652 0.84 RAB9A (0.73) RAB9AKMT2ANPC1CRBNDDB1
Hydrochloric Acid SCHEMBL25232851 0.84 P2RY12 (0.59) RAB9AKMT2ANPC1CRBNHRH3
Hydrochloric Acid SCHEMBL31570844 0.84 P2RY12 (0.59) RAB9AKMT2ANPC1CRBNHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12312316-B2 Compounds and methods for the targeted degradation of androgen receptor ARVINAS OPERATIONS, INC. (US) 2025-05-27 US disclosed
US-12195472-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2025-01-14 US disclosed
WO-2023192989-A2 PHTHALAZINONE COMPOUNDS AS PARP7 INHIBITORS AZKARRA THERAPEUTICS, INC. (US) 2023-10-05 WO disclosed
WO-2023192989-A2 PHTHALAZINONE COMPOUNDS AS PARP7 INHIBITORS AZKARRA THERAPEUTICS, INC. (US) 2023-10-05 WO disclosed
US-20230039309-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-02-09 US disclosed
US-11427548-B2 Compounds and methods for the targeted degradation of androgen receptor ARVINAS OPERATIONS, INC. (US) 2022-08-30 US disclosed
US-20220144838-A1 Compounds as Inhibitors of Macrophage Migration Inhibitory Factor Nanjing Immunophage Biotech Co., Ltd. (CN) 2022-05-12 US disclosed
EP-3419971-B1 GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2022-04-20 EP disclosed
US-11208415-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2021-12-28 US disclosed
US-20210186958-A1 GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2021-06-24 US disclosed
EP-0934312-A1 1,4-DISUBSTITUTED PIPERAZINES NOVO NORDISK A/S (DK) 1999-08-11 EP disclosed
US-5916889-A ANTIDIABETIC AGENT; DIETETICS NOVO NORDISK A/S (DK) 1999-06-29 US disclosed
WO-1999020606-A2 PIPERIDINES AND PIPERAZINES AS PLATELET AGGREGATION INHIBITORS J. URIACH & CIA. S.A. (ES) 1999-04-29 WO disclosed
WO-1998015548-A1 1,4-DISUBSTITUTED PIPERAZINES NOVO NORDISK A/S (DK) 1998-04-16 WO disclosed
EP-0385351-B1 Nicotinic acid derivatives and pharmaceutical compositions comprising same NISSHIN FLOUR MILLING CO (JP) 1995-01-11 EP disclosed
EP-0385350-B1 Pyridinecarboxylic acid amide derivatives and pharmaceutical compositions comprising same NISSHIN FLOUR MILLING CO (JP) 1994-11-30 EP disclosed
US-5025012-A Cardiovascular disorders; antiischemic agents NISSHIN FLOUR MILLING CO., LTD. (JP) 1991-06-18 US disclosed
US-4994456-A Hypotensive agents NISSHIN FLOUR MILLING CO., LTD. (JP) 1991-02-19 US disclosed
EP-0385351-A1 Nicotinic acid derivatives and pharmaceutical compositions comprising same NISSHIN FLOUR MILLING CO., LTD. (JP) 1990-09-05 EP disclosed
EP-0385350-A1 Pyridinecarboxylic acid amide derivatives and pharmaceutical compositions comprising same NISSHIN FLOUR MILLING CO., LTD. (JP) 1990-09-05 EP 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 (7 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-20220144838-A1 Compounds as Inhibitors of Macrophage Migration Inhibitory Factor MIF, MMP12, SLC11A2 RAB9A 1346/4885KMT2A 3645/4885NPC1 160/4885
US-20210186958-A1 GLYCOSIDASE INHIBITORS ENGASE, GAA, GLA RAB9A 931/4885KMT2A 918/4885NPC1 449/4885
US-12312316-B2 Compounds and methods for the targeted degradation of androgen receptor AR, MDM2, ESRRA RAB9A 4010/4885KMT2A 1478/4885NPC1 1813/4885
US-20230039309-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL3 RAB9A 3796/4885KMT2A 670/4885NPC1 2000/4885
US-12195472-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL3 RAB9A 3796/4885KMT2A 670/4885NPC1 2000/4885
US-11427548-B2 Compounds and methods for the targeted degradation of androgen receptor AR, MDM2, ESRRA RAB9A 4010/4885KMT2A 1478/4885NPC1 1813/4885
US-11208415-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL3 RAB9A 3796/4885KMT2A 670/4885NPC1 2000/4885

“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.