SCHEMBL25331238

SCHEMBL25331238

CSCc1cc(NC(=O)O)ccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS3 P29474 1/20 0.47
▸ NOS1 P29475 1/20 0.47
▸ NOS2 P35228 1/20 0.47
▸ PRKCI P41743 1/20 0.47
▸ SORT1 Q99523 3/20 0.42
▸ SMARCA2 P51531 2/20 0.40
▸ SMARCA4 P51532 2/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KMT2A Q03164 2/20 0.36
▸ GBA1 P04062 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ AR P10275 2/20 0.35

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
SCHEMBL15880501 0.83 PRKCI (0.62) PRKCISORT1SMARCA2SMARCA4SMN1; SMN2
SCHEMBL30530884 0.80 SREBF2 (0.45) NOS3NOS1NOS2PRKCI
SCHEMBL28292631 0.80 PRKCI (0.48) PRKCISORT1SMARCA2SMARCA4SMN1; SMN2
SCHEMBL19306076 0.78 PRKCI (0.46) PRKCISORT1SMARCA2SMARCA4SMN1; SMN2
SCHEMBL28940889 0.77 PRKCI (0.46) PRKCISORT1SMARCA2SMARCA4KMT2A
SCHEMBL15880685 0.74 SMARCA2 (0.65) SORT1SMARCA2SMARCA4KMT2A
SCHEMBL1336857 0.74 CCNC (0.48) PRKCISMARCA2SMARCA4SMN1; SMN2NPC1
SCHEMBL23015823 0.72 PRKCI (0.61) PRKCINPC1RAB9ALMNAKMT2A
SCHEMBL25174663 0.72 ANO1 (0.44) PRKCISMN1; SMN2NPC1RAB9AMAPK1
SCHEMBL27627388 0.71 PRKCI (0.63) PRKCISMARCA2SMARCA4LMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024131938-A1 QUINAZOLINE COMPOUND AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2024-06-27 — — WO disclosed
WO-2023143135-A1 QUINAZOLINE DERIVATIVE AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2023-08-03 — — WO disclosed
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