SCHEMBL22040133

SCHEMBL22040133

C[C@@H]1CCC(c2ccc(F)cc2)=N1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.38
NOS1 P29475 2/20 0.38
NOS2 P35228 2/20 0.38
HRH2 P25021 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAOB P27338 4/20 0.36
APAF1 O14727 1/20 0.36
POLB P06746 1/20 0.36
GRK2 P25098 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
PTGS2 P35354 3/20 0.35
PTGS1 P23219 2/20 0.35
MAPK14 Q16539 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAOA P21397 2/20 0.34

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
SCHEMBL22039704 1.00 NOS3 (0.38) NOS3NOS1NOS2HRH2HRH3
SCHEMBL22040850 1.00 NOS3 (0.38) NOS3NOS1NOS2HRH2HRH3
SCHEMBL23878330 0.80 CYP11B2 (0.36) NOS3NOS1NOS2RAB9ANPC1
SCHEMBL22039488 0.80 CYP11B2 (0.36) NOS3NOS1NOS2RAB9ANPC1
SCHEMBL22546622 0.80 NISCH (0.41) NOS3NOS1NOS2HRH2HRH3
SCHEMBL22546693 0.80 NISCH (0.41) NOS3NOS1NOS2HRH2HRH3
SCHEMBL22039769 0.78 NOS3 (0.39) NOS3NOS1NOS2APOBEC3GMAPK14
SCHEMBL23878299 0.78 NOS3 (0.39) NOS3NOS1NOS2APOBEC3GMAPK14
SCHEMBL22039541 0.78 MAOB (0.41) HRH2HRH3RAB9ANPC1MAOB
SCHEMBL22040181 0.76 NISCH (0.41) PTGS2PTGS1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3889138-B1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF HINOVA PHARMACEUTICALS INC (CN) 2024-11-20 EP disclosed
US-20220087996-A1 Histone acetylase p300 inhibitor and use thereof HINOVA PHARMACEUTICALS INC. (CN) 2022-03-24 US disclosed
US-20220087996-A1 Histone acetylase p300 inhibitor and use thereof HINOVA PHARMACEUTICALS INC. (CN) 2022-03-24 US disclosed
CN-111217802-B Histone acetylase p300 inhibitor and application thereof 海创药业股份有限公司 2021-10-08 CN disclosed
EP-3889138-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-10-06 EP disclosed
WO-2020108500-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF 成都海创药业有限公司 2020-06-04 WO disclosed
CN-111217802-A Histone acetylase p300 inhibitor and application thereof 成都海创药业有限公司 2020-06-02 CN 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 (1 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-20220087996-A1 Histone acetylase p300 inhibitor and use thereof EP300, HDAC1, HDAC11 NOS3 4421/4885NOS1 4145/4885NOS2 4582/4885

“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.