SCHEMBL29796107

SCHEMBL29796107

Cn1ccc(-c2cccc(NC(=O)O)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
GPR142 Q7Z601 1/20 0.51
FYN P06241 3/20 0.48
MAPK14 Q16539 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 1/20 0.47
TP53 P04637 1/20 0.47
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 2/20 0.46
CREBBP Q92793 1/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
MGLL Q99685 1/20 0.45
LMNA P02545 1/20 0.44
CNR1 P21554 1/20 0.44
GFER P55789 1/20 0.44

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
SCHEMBL23213539 0.83 CYP1A2 (0.55) KMT2AGPR142FYNSMN1; SMN2NPC1
SCHEMBL28633205 0.81 KMT2A (0.55) KMT2ASMN1; SMN2NPC1RAB9AMEN1
SCHEMBL25200778 0.80 HDAC3 (0.47) SMN1; SMN2NPC1RAB9AALDH1A1KDM4E
SCHEMBL8312473 0.80 KMT2A (0.56) KMT2AGPR142FYNSMN1; SMN2ALDH1A1
SCHEMBL939191 0.78 JMJD6 (0.65) KMT2ASMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL10389277 0.76 SMN1; SMN2 (0.71) KMT2ASMN1; SMN2MEN1ALDH1A1KDM4E
SCHEMBL2829641 0.76 NTRK1 (0.44) KMT2AGPR142FYNKDM4ECREBBP
SCHEMBL13996489 0.76 KMT2A (0.51) KMT2AGPR142SMN1; SMN2NPC1RAB9A
SCHEMBL13993983 0.76 KMT2A (0.51) KMT2AGPR142FYNMAPK14SMN1; SMN2
SCHEMBL17240174 0.75 JMJD6 (0.54) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4041231-A1 ISOINDOLINONE COMPOUNDS Monte Rosa Therapeutics AG (CH) 2022-08-17 EP disclosed