SCHEMBL28259968

SCHEMBL28259968

O=C(Nc1ccccc1Cl)c1ccc(-c2cccc3c2C=CCC3)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.48
▸ RAB9A P51151 7/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ MAPT P10636 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ HPGD P15428 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ APOBEC3A P31941 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ APOBEC3G Q9HC16 1/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ POLB P06746 1/20 0.41

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
SCHEMBL28259952 0.84 PTPN1 (0.52) SMN1; SMN2KDM4EPOLBHDAC8HDAC6
SCHEMBL28866664 0.81 PTPN1 (0.52) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL27972549 0.80 SMO (0.53) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL27972606 0.76 KDM4E (0.51) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL27972353 0.76 NAMPT (0.51) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL27972318 0.76 PTPN1 (0.48) NPC1MEN1KMT2AMAPTLMNA
SCHEMBL27972313 0.75 KCNJ5 (0.50) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL28261352 0.75 CHRNB2 (0.45) NPC1RAB9AKMT2AMAPTLMNA
SCHEMBL28813725 0.74 GRM1 (0.46) KDM4E
SCHEMBL27972571 0.74 EPHX2 (0.48) NPC1RAB9AMAPK1HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108863959-B P2X4 receptor antagonists 日本化学药品株式会社 2021-11-30 — — CN disclosed
CN-111333588-A P2X4 receptor antagonists 日本化学药品株式会社 2020-06-26 — — CN disclosed
CN-110483423-A P2X4 receptor antagonist NIPPON CHEMIPHAR CO 2019-11-22 — — CN disclosed
CN-108863959-A P2X4 RECEPTOR ANTAGONIST 日本化学药品株式会社 2018-11-23 — — CN disclosed
Send feedback