SCHEMBL9205772

SCHEMBL9205772

COC(=O)c1ccccc1NC(=O)Cc1c[nH]c2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.65
MAPK9 P45984 1/20 0.65
MAPK10 P53779 1/20 0.65
KMT2A Q03164 3/20 0.62
NR4A2 P43354 1/20 0.57
CREBBP Q92793 1/20 0.57
MAPT P10636 4/20 0.55
HPGD P15428 1/20 0.55
HSD17B10 Q99714 3/20 0.53
MEN1 O00255 1/20 0.53
STAT3 P40763 1/20 0.53
RAB9A P51151 1/20 0.53
ALDH1A1 P00352 3/20 0.53
CYP1A2 P05177 1/20 0.53
POLB P06746 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
PKM P14618 1/20 0.53

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
SCHEMBL9203635 0.88 MAPT (0.64) MAPK8MAPK9MAPK10KMT2ANR4A2
SCHEMBL28619019 0.86 MAPK8 (0.55) MAPK8KMT2AMAPTHPGDHSD17B10
SCHEMBL28373439 0.86 MAPT (0.74) KMT2AMAPTHPGDMEN1ALDH1A1
SCHEMBL9205145 0.86 KMT2A (0.62) MAPK8KMT2AMAPTHPGDHSD17B10
SCHEMBL28341452 0.84 MAPT (0.75) KMT2AMAPTHPGDHSD17B10MEN1
SCHEMBL9202235 0.83 CFTR (0.57) MAPK8KMT2AMAPTHPGDHSD17B10
SCHEMBL18229452 0.82 CTSL (0.62) MAPK8KMT2AMAPTHPGDHSD17B10
SCHEMBL10364445 0.81 MAPT (0.74) KMT2AMAPTMEN1RAB9AALDH1A1
SCHEMBL28369557 0.81 MAPT (0.58) MAPK8KMT2AMAPTHPGDHSD17B10
SCHEMBL28869825 0.81 HRH3 (0.64) KMT2AMAPTHSD17B10MEN1STAT3

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
CN-113004188-B Indole derivative, preparation method and application 沈阳药科大学 2022-09-20 CN disclosed
CN-113248399-A O-amino aromatic amide derivative and preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2021-08-13 CN disclosed
CN-113004188-A Indole derivative, preparation method and application 沈阳药科大学 2021-06-22 CN disclosed
EP-0475755-B1 3-Aryl-4(3H)quinazolinone CCK antagonists and pharmaceutical formulations thereof LILLY CO ELI (US) 1995-09-27 EP disclosed
US-5196427-A Gastrointestinal and central nervous system disorders; hormone inhibitors ELI LILLY AND COMPANY (US) 1993-03-23 US disclosed
EP-0475755-A1 3-Aryl-4(3H)quinazolinone CCK antagonists and pharmaceutical formulations thereof ELI LILLY AND COMPANY (US) 1992-03-18 EP disclosed
US-5075313-A For bindign to cholecystokinin receptors ELI LILLY AND COMPANY (US) 1991-12-24 US disclosed