SCHEMBL10688694

SCHEMBL10688694

O=Cc1ccc2c(c1)CC(Cc1ccccc1)CN2Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 3/20 0.46
▸ MTNR1B P49286 3/20 0.46
▸ CCR3 P51677 1/20 0.37
▸ HPGD P15428 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ TSHR P16473 1/20 0.36
▸ MAPT P10636 3/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ RECQL P46063 2/20 0.36
▸ BRS3 P32247 1/20 0.36
▸ ALDH1A3 P47895 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL10691680 0.81 HPGD (0.47) HPGDKMT2AMEN1POLB
SCHEMBL10691674 0.81 HPGD (0.47) HPGDKMT2AMEN1POLB
SCHEMBL10689632 0.80 MTNR1A (0.62) MTNR1AMTNR1BCCR3HPGDTSHR
SCHEMBL3218987 0.77 HPGD (0.48) HPGDALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL1461837 0.74 ALDH1A1 (0.56) HPGDALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL7574987 0.73 GAA (0.48) HPGDALDH1A1KMT2AMEN1LMNA
SCHEMBL12194126 0.73 ALOX12 (0.45) HPGDTSHRBRD4CACNA1GCACNA1H
SCHEMBL10690377 0.73 PPARG (0.50) MTNR1AMTNR1BALDH1A1KMT2AMAPT
SCHEMBL10684454 0.73 CYP19A1 (0.50) SIGMAR1
SCHEMBL7436181 0.71 HPGD (0.62) CCR3HPGDALDH1A1KMT2ASMN1; SMN2

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-4738972-A Hypoglycemic thiazolidinediones PFIZER INC. (US) 1988-04-19 — — US disclosed
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