SCHEMBL10827674

SCHEMBL10827674

Cn1c(CSC#N)nc2cc(C(F)(F)F)ccc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.41
▸ CTSD P07339 2/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ F7 P08709 1/20 0.37
▸ F3 P13726 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PSMD14 O00487 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ CTSK P43235 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34

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
SCHEMBL10827107 0.91 DDR1 (0.38) PDE10APOLBTDP1KDM4EMEN1
SCHEMBL10827676 0.85 RORA (0.45) PDE10AKCNH2HRH3POLBTDP1
SCHEMBL10827393 0.82 LMNA (0.49) CTSDKCNH2HRH3KDM4EMEN1
SCHEMBL10827069 0.82 CYP3A4 (0.46) PDE10ATDP1KDM4EMEN1KMT2A
SCHEMBL10827062 0.80 CTSD (0.45) PDE10ACTSDKCNH2HRH3KDM4E
SCHEMBL10828363 0.79 TDP1 (0.36) POLBTDP1KDM4EL3MBTL1HDAC6
SCHEMBL10827322 0.76 RORA (0.45) POLBTDP1KDM4ECTSKALDH1A1
SCHEMBL10827385 0.75 KDM4E (0.44) PDE10APOLBTDP1KDM4EMEN1
SCHEMBL10827110 0.74 KLK7 (0.48) KDM4EMEN1KMT2ACTSKALDH1A1
SCHEMBL10827670 0.72 PARG (0.44) POLBTDP1KDM4EL3MBTL1HDAC6

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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