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Sugi Predict / Compounds / SCHEMBL20143907

SCHEMBL20143907

SCHEMBL20143907

Cc1ccc(N(c2ccc([Si](c3ccc(N(c4ccc(C)cc4C)c4ccc(C)cc4C)cc3)(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc2)c2ccc(C)cc2C)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.40
▸ HCRTR2 O43614 1/20 0.32
▸ PTAFR P25105 1/20 0.31
▸ KDM4C Q9H3R0 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ HSD17B2 P37059 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ POLB P06746 1/20 0.30

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
SCHEMBL20143910 0.96 TSHR (0.37) TSHRHCRTR2PTAFRMAPTKDM4E
SCHEMBL20143908 0.95 TSHR (0.36) TSHR
SCHEMBL18104303 0.93 TSHR (0.41) TSHRHCRTR2NPC1MAPTRAB9A
SCHEMBL20143912 0.92 TSHR (0.35) TSHRKDM4CKDM4EALDH1A1LMNA
SCHEMBL18104291 0.88 ALDH1A1 (0.34) TSHRKDM4EALDH1A1
SCHEMBL13322025 0.88 TSHR (0.48) TSHRHCRTR2PTAFRKDM4CNPC1
SCHEMBL17807601 0.84 TSHR (0.50) TSHRHCRTR2PTAFRNPC1MAPT
SCHEMBL20143913 0.83 TSHR (0.39) TSHRHCRTR2HSD17B2ALDH1A1LMNA
SCHEMBL18104319 0.83 ALDH1A1 (0.31) TSHRALDH1A1
SCHEMBL18104281 0.82 CYP2C19 (0.34) TSHRALDH1A1LMNA

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-9972783-B2 High energy triarylamine compounds for hole transport materials E I DU PONT DE NEMOURS AND COMPANY (US) 2018-05-15 — — US disclosed