SCHEMBL10827322

SCHEMBL10827322

CCCCn1c(CSC#N)nc2ccc(C(F)(F)F)cc2c1=O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RORA P35398 7/20 0.45
▸ RORC P51449 7/20 0.45
▸ RORB Q92753 7/20 0.45
▸ CTSK P43235 1/20 0.43
▸ CNR1 P21554 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ PTK2B Q14289 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ PGR P06401 4/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ NR1H2 P55055 1/20 0.37
▸ DDR1 Q08345 2/20 0.37
▸ POLB P06746 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL10827676 0.92 RORA (0.45) RORARORCRORBCTSKCNR1
SCHEMBL10827107 0.85 DDR1 (0.38) CTSKALDH1A1KDM4ETDP1DDR1
SCHEMBL10827671 0.84 DPP4 (0.43) RORARORCRORBTSHRPTK2B
SCHEMBL10828444 0.82 TSHR (0.41) TSHRPTK2BALDH1A1KDM4ETDP1
SCHEMBL10828440 0.78 NPSR1 (0.45) RORARORCRORBTSHRPTK2B
SCHEMBL10827110 0.78 KLK7 (0.48) CTSKALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL10827674 0.76 PDE10A (0.41) CTSKALDH1A1KDM4ETDP1POLB
SCHEMBL10827126 0.76 TSHR (0.41) TSHRPTK2BALDH1A1KDM4ETDP1
SCHEMBL10828432 0.75 ALDH1A1 (0.43) CTSKTSHRALDH1A1KDM4EDDR1
SCHEMBL10827393 0.71 LMNA (0.49) CTSKALDH1A1KDM4EMAPTSMN1; SMN2

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-4605657-A 4-quinazalone fungicides CHEVRON RESEARCH COMPANY (US) 1986-08-12 — — US disclosed
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