SCHEMBL11768569

SCHEMBL11768569

CCC1c2ccccc2C(C)C1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 2/20 0.38
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP11B2 P19099 1/20 0.33
PRCP P42785 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HDAC4 P56524 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11766654 0.73 EDNRA (0.41) MEN1KMT2ASMN1; SMN2LMNAGAA
SCHEMBL11548867 0.69 SIGMAR1 (0.44)
SCHEMBL8475334 0.68 MEN1 (0.34) MEN1KMT2ASMN1; SMN2LMNAGAA
SCHEMBL18402943 0.65 ALDH1A1 (0.38) MEN1KMT2ASMN1; SMN2LMNAMAPK1
SCHEMBL14555192 0.64 CYP11B2 (0.43) CYP11B2PRCP
SCHEMBL8435497 0.64 MAOA (0.41) MEN1KMT2ACYP2C19HDAC4
SCHEMBL30504112 0.64 MAOA (0.41) MEN1KMT2ALMNACYP1A2CYP2D6
SCHEMBL30312236 0.64 MAOA (0.41) MEN1KMT2ACYP2C19HDAC4
SCHEMBL30311870 0.64 MAOA (0.41) MEN1KMT2ACYP2C19HDAC4
SCHEMBL30312066 0.64 MAOA (0.41) MEN1KMT2ACYP2C19HDAC4

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
US-3939095-A PHENYLINDANES, ADDITION COPOLYMERS BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-02-17 US claimed
US-3939095-A PHENYLINDANES, ADDITION COPOLYMERS BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-02-17 US disclosed