SCHEMBL11760855

SCHEMBL11760855

C1=Cc2ccncc2Cc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 4/20 0.46
▸ CYP11B1 P15538 3/20 0.46
▸ TRPA1 O75762 2/20 0.41
▸ CYP19A1 P11511 5/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ P2RX4 Q99571 1/20 0.37
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ TNF P01375 2/20 0.33
▸ EED O75530 1/20 0.33
▸ NOTUM Q6P988 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 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
SCHEMBL19447878 0.88 CYP11B2 (0.46) CYP11B2CYP11B1TRPA1CYP19A1SIGMAR1
SCHEMBL24592280 0.84 CYP11B2 (0.49) CYP11B2CYP11B1CYP19A1SIGMAR1P2RX4
SCHEMBL13859957 0.80 CYP11B1 (0.34) CYP11B2CYP11B1CYP19A1SIGMAR1CHRNB2
SCHEMBL31586332 0.80 TRPA1 (0.50) CYP11B2CYP11B1TRPA1PARP1CA1
SCHEMBL283346 0.80 TRPA1 (0.50) CYP11B2CYP11B1TRPA1PARP1CA1
SCHEMBL2007099 0.76 SIGMAR1 (0.42) CYP19A1SIGMAR1P2RX4CHRNB2CHRNA4
SCHEMBL24592357 0.76 CYP11B2 (0.49) CYP11B2CYP11B1CYP19A1SIGMAR1CHRNB2
SCHEMBL11681566 0.76 CYP11B2 (0.37) CYP11B2CYP11B1TRPA1CYP19A1TNF
SCHEMBL9948368 0.71 SIGMAR1 (0.45) CYP11B2CYP11B1CYP19A1SIGMAR1CHRNB2
SCHEMBL30322772 0.71 MAOA (0.47) CYP11B2CYP11B1CYP19A1SIGMAR1TNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11678498-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-13 — — US disclosed
US-20170294613-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-10-12 — — US disclosed
US-4034095-A ANTIDEPRESSANT, ANTICHOLINERGIC SANDOZ LTD. (CH) 1977-07-05 — — US disclosed
US-4034095-A ANTIDEPRESSANT, ANTICHOLINERGIC SANDOZ LTD. (CH) 1977-07-05 — — US disclosed
US-4034095-A ANTIDEPRESSANT, ANTICHOLINERGIC SANDOZ LTD. (CH) 1977-07-05 — — US disclosed
US-4024265-A ANTIDEPRESSANTS SANDOZ LTD. (CH) 1977-05-17 — — US disclosed
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