SCHEMBL3970760

SCHEMBL3970760

c1ccc(-c2nnco2)cc1.c1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 14/20 0.78
▸ TLR8 Q9NR97 1/20 0.62
▸ TSHR P16473 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ CDC7 O00311 1/20 0.44
▸ DBF4 Q9UBU7 1/20 0.44

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
SCHEMBL9555 0.88 NOTUM (1.00) NOTUMTLR8TSHRALDH1A1KDM4E
Biphenyl SCHEMBL22577775 0.86 NOTUM (0.95) NOTUMTLR8TSHRALDH1A1KDM4E
SCHEMBL5571187 0.84 NOTUM (0.91) NOTUMTLR8TSHRALDH1A1KDM4E
SCHEMBL10706623 0.81 NOTUM (0.60) NOTUMTLR8TSHRALDH1A1KDM4E
SCHEMBL11232897 0.79 NOTUM (0.74) NOTUMTLR8ALDH1A1KDM4ELMNA
SCHEMBL21795694 0.78 NOTUM (0.75) NOTUMTLR8ALDH1A1KDM4ELMNA
SCHEMBL17694561 0.77 NOTUM (0.78) NOTUMTLR8TSHRALDH1A1KDM4E
SCHEMBL17197374 0.76 NOTUM (0.74) NOTUMTLR8TSHRALDH1A1KDM4E
SCHEMBL2610163 0.75 NOTUM (0.75) NOTUMTLR8TSHRALDH1A1KDM4E
Acetamide SCHEMBL28274790 0.75 NOTUM (0.72) NOTUMTLR8TSHRALDH1A1KDM4E

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
EP-2025014-A1 PENTACENE POLYMERS AND THEIR USE IN ELECTRONIC DEVICES LUCENT TECHNOLOGIES INC. (US) 2009-02-18 — — EP disclosed
WO-2007130570-A1 PENTACENE POLYMERS AND THEIR USE IN ELECTRONIC DEVICES LUCENT TECHNOLOGIES INC. (US) 2007-11-15 — — WO disclosed
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