SCHEMBL18998907

SCHEMBL18998907

Cc1ccc(-c2cc3c(s2)-c2ccc4c(c2CC3)CCc2cc(-c3ccc(C)cc3)sc2-4)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 11/20 0.40
▸ ESR1 P03372 4/20 0.37
▸ ESR2 Q92731 4/20 0.37
▸ KDM4E B2RXH2 4/20 0.34
▸ GLA P06280 4/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ GAA P10253 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ ATM Q13315 2/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ POLB P06746 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL13671139 0.87 PARP10 (0.38) NOTUMESR1ESR2KDM4EGLA
SCHEMBL19005912 0.82 PLK1 (0.39) NOTUMMAPTL3MBTL1
SCHEMBL12711295 0.77 ESR1 (0.39) ESR1ESR2KDM4EALDH1A1GAA
SCHEMBL17122402 0.76 ESR1 (0.39) ESR1ESR2KDM4EALDH1A1GAA
SCHEMBL11521591 0.70 ESR1 (0.66) ESR1ESR2KDM4EMAPTSMN1; SMN2
SCHEMBL12924298 0.69 ESR1 (0.42) ESR1ESR2KDM4EALDH1A1GAA
SCHEMBL12924307 0.69 ESR1 (0.42) ESR1ESR2KDM4EALDH1A1GAA
SCHEMBL15763749 0.69 PDK2 (0.31) —
SCHEMBL15060523 0.69 PARP10 (0.36) ESR1ESR2KDM4EGLAALDH1A1
SCHEMBL12361198 0.67 ESR1 (0.71) ESR1ESR2KDM4EALDH1A1MAPT

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-20170179415-A1 ORGANIC FIELD-EFFECT TRANSISTOR, METHOD FOR MANUFACTURING ORGANIC SEMICONDUCTOR CRYSTAL, AND ORGANIC SEMICONDUCTOR ELEMENT FUJIFILM CORPORATION (JP) 2017-06-22 — — US disclosed
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