SCHEMBL8934707

SCHEMBL8934707

Cc1cccc(N2CCc3ccccc32)c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
ATM Q13315 1/20 0.48
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
SRD5A1 P18405 2/20 0.47
ADRB1 P08588 1/20 0.46
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
ALOX15 P16050 2/20 0.43
ROCK1 Q13464 1/20 0.43
HPGD P15428 1/20 0.43
USP2 O75604 1/20 0.43
CDK4 P11802 1/20 0.43
CCND1 P24385 1/20 0.43
HSD17B10 Q99714 1/20 0.43
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL8334755 0.90 MEN1 (0.46) SMN1; SMN2ATMALDH1A1MEN1KMT2A
SCHEMBL25026229 0.87 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1MEN1KMT2ASRD5A1
SCHEMBL17179753 0.84 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1MEN1KMT2ASRD5A1
SCHEMBL5923921 0.75 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1MEN1KMT2ASRD5A1
SCHEMBL17074033 0.75 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1MEN1KMT2ASRD5A1
SCHEMBL8938754 0.73 LMNA (0.53) SMN1; SMN2ALDH1A1MEN1KMT2ASRD5A1
SCHEMBL12307044 0.73 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1MEN1KMT2ASRD5A1
SCHEMBL19025755 0.72 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1MEN1KMT2ASRD5A1
SCHEMBL31092800 0.72 HPGD (0.56) SMN1; SMN2ATMALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL10547839 0.72 MAPK1 (0.51) SMN1; SMN2ALDH1A1MEN1KMT2ASRD5A1

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
WO-1996030014-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 WO disclosed