SCHEMBL8916445

SCHEMBL8916445

CC1CCCN1c1c(-c2ccccc2F)c(Cl)nc2ncnn12

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
GLA P06280 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
EGLN2 Q96KS0 1/20 0.41
PDE2A O00408 16/20 0.40
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL8915863 0.97 TSHR (0.42) TSHRGLANPSR1EGLN2PDE2A
SCHEMBL4819318 0.90 PDE2A (0.43) TSHRGLANPSR1EGLN2PDE2A
SCHEMBL8911798 0.90 GLA (0.42) TSHRGLANPSR1EGLN2PDE2A
SCHEMBL8912954 0.87 PDE2A (0.43) TSHRGLANPSR1EGLN2PDE2A
SCHEMBL8919073 0.87 PDE2A (0.41) TSHRGLANPSR1EGLN2PDE2A
SCHEMBL7493479 0.84 EGLN2 (0.43) TSHRGLANPSR1EGLN2PDE2A
SCHEMBL4819706 0.84 PDE2A (0.40) TSHRGLANPSR1EGLN2PDE2A
SCHEMBL5593283 0.84 PDE2A (0.40) EGLN2PDE2A
SCHEMBL4812000 0.83 EGLN2 (0.45) TSHREGLN2PDE2AALDH1A1LMNA
SCHEMBL5593335 0.82 PDE2A (0.39) EGLN2PDE2A

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-5593996-A FUNGICIDES AMERICAN CYANAMID COMPANY (US) 1997-01-14 US disclosed