SCHEMBL10795683

SCHEMBL10795683

Cc1ccccc1Cc1cncn1Cc1ccccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.49
CYP11B2 P19099 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
P2RX7 Q99572 1/20 0.41
POLB P06746 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
FNTA P49354 2/20 0.39
FNTB P49356 2/20 0.39
PGGT1B P53609 1/20 0.39
KMT2A Q03164 1/20 0.39
ADRA2C P18825 1/20 0.39
NPC1 O15118 1/20 0.39
GALR3 O60755 1/20 0.39
NR2F2 P24468 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
SCHEMBL11049913 0.89 CYP11B1 (0.54) CYP11B1CYP11B2SMN1; SMN2CYP3A4CYP2D6
SCHEMBL10792381 0.84 FNTA (0.38) CYP11B1CYP11B2SMN1; SMN2TSHRCYP3A4
SCHEMBL10792635 0.80 CYP11B1 (0.42) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL10792243 0.79 P2RX7 (0.43) CYP11B1CYP11B2SMN1; SMN2P2RX7POLB
SCHEMBL10795646 0.77 SMN1; SMN2 (0.44) CYP11B1CYP11B2SMN1; SMN2P2RX7POLB
SCHEMBL1950417 0.76 CYP11B1 (0.64) CYP11B1CYP11B2SMN1; SMN2TSHRCYP3A4
SCHEMBL10792230 0.76 FNTA (0.43) CYP11B1CYP11B2SMN1; SMN2POLBFNTA
SCHEMBL10790941 0.75 ACP1 (0.43) CYP11B1CYP11B2FNTAFNTBKMT2A
SCHEMBL10794794 0.75 AVPR2 (0.41) CYP11B1CYP11B2SMN1; SMN2P2RX7POLB
SCHEMBL3913519 0.74 SMN1; SMN2 (0.55) CYP11B1CYP11B2SMN1; SMN2TSHRCYP3A4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE32400-E Substituted imidazole derivatives and their use as anti-thrombosis agents FARMOS YHTYMA OY (FI) 1987-04-14 US disclosed
US-4514412-A HYPOTENSIVES, BETA BLOCKERS FARMOS YHTYMA OY (FI) 1985-04-30 US disclosed
EP-0058047-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE Farmos-Yhtyma Oy (FI) 1984-11-07 EP disclosed