SCHEMBL8043471

SCHEMBL8043471

Clc1ccc(-c2csc(Sc3nnc(-c4cccs4)s3)n2)cc1.c1ccc(-c2csc(Sc3nnc(-c4cccs4)s3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
RAB9A P51151 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 2/20 0.41
EPHX2 P34913 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALOX5 P09917 1/20 0.41
CYP1A1 P04798 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP1B1 Q16678 1/20 0.40
CYP19A1 P11511 2/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39

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
SCHEMBL8043773 0.88 KMT2A (0.47) KDM4ERAB9ASMN1; SMN2LMNAALOX5
SCHEMBL8050637 0.80 HDAC6 (0.49) KDM4ERAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL8043837 0.76 KDM4E (0.40) KDM4ERAB9ASMN1; SMN2ALDH1A1EPHX2
SCHEMBL8044404 0.76 ATM (0.44) KDM4ERAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL10715489 0.76 RAB9A (0.67) KDM4ERAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL8042056 0.75 FBP1 (0.51) KDM4ERAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL8051082 0.74 TSHR (0.55) KDM4ERAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL8041816 0.74 RAB9A (0.47) KDM4ERAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL8042588 0.74 KDM4E (0.46) KDM4ERAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL8032807 0.73 MEN1 (0.45) KDM4ERAB9ASMN1; SMN2LMNAALDH1A1

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
US-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed