SCHEMBL8473162

SCHEMBL8473162

Nc1ccc2c(c1)CCNC2C(=O)Cc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TBXA2R P21731 2/20 0.42
▸ KDM1A O60341 3/20 0.39
▸ OPRM1 P35372 2/20 0.38
▸ OPRD1 P41143 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ TSHR P16473 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ ADRB2 P07550 1/20 0.34
▸ PRCP P42785 1/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ ALPL P05186 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ RIN1 Q13671 1/20 0.33
▸ MAPKAPK2 P49137 1/20 0.33

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
SCHEMBL8470780 0.88 TBXA2R (0.42) TBXA2RKDM1AOPRM1OPRD1OPRK1
SCHEMBL6968049 0.88 TSHR (0.47) TBXA2RKDM1AOPRM1TSHRNPSR1
SCHEMBL8472702 0.84 TBXA2R (0.50) TBXA2RKDM1AMEN1GAAKMT2A
SCHEMBL6967844 0.81 OPRM1 (0.42) TBXA2ROPRM1OPRK1TSHRNPSR1
SCHEMBL8471637 0.81 OPRM1 (0.42) TBXA2ROPRM1OPRD1OPRK1TSHR
SCHEMBL8472080 0.81 KDM1A (0.47) TBXA2RKDM1AADRB2MEN1KMT2A
SCHEMBL6973757 0.78 TBXA2R (0.40) TBXA2RKDM1ATSHRNPSR1ADRB2
SCHEMBL6966660 0.77 TSHR (0.40) TBXA2ROPRM1OPRK1TSHRNPSR1
SCHEMBL6969520 0.77 TBXA2R (0.39) TBXA2RKDM1AOPRM1TSHRNPSR1
SCHEMBL8472751 0.76 HDAC8 (0.42) TBXA2RKDM1AOPRM1OPRD1OPRK1

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-5919795-A ATHEROSCLEROSIS THERAPY PFIZER INC. (US) 1999-07-06 — — US disclosed
Send feedback