SCHEMBL10992667

SCHEMBL10992667

CCN1CCSC1=NC(=O)Nc1c(Cl)cccc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ HPGD P15428 1/20 0.40
▸ P2RX7 Q99572 3/20 0.39
▸ PTGS2 P35354 1/20 0.38
▸ GBA1 P04062 1/20 0.36
▸ PDK1 Q15118 1/20 0.34
▸ PDK2 Q15119 1/20 0.34
▸ PDK3 Q15120 1/20 0.34
▸ PDK4 Q16654 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ TYK2 P29597 1/20 0.33

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
SCHEMBL10994318 0.94 GRM5 (0.42) GRM5L3MBTL1P2RX7TP53POLB
SCHEMBL10994616 0.90 GRM5 (0.49) GRM5L3MBTL1P2RX7PDK1PDK2
SCHEMBL11000472 0.90 GRM5 (0.39) GRM5HPGDP2RX7TP53POLB
SCHEMBL10993445 0.87 GRM5 (0.45) GRM5POLBTDP1
SCHEMBL10994676 0.87 ATM (0.38) GRM5L3MBTL1HPGDP2RX7TP53
SCHEMBL10998692 0.86 GRM5 (0.59) GRM5L3MBTL1HPGDP2RX7PTGS2
SCHEMBL10994165 0.86 GRM5 (0.46) GRM5PDK1PDK2PDK3PDK4
SCHEMBL11148675 0.80 L3MBTL1 (0.52) L3MBTL1HPGDP2RX7PTGS2GBA1
SCHEMBL10998809 0.80 GRM5 (0.45) GRM5L3MBTL1POLBTDP1
SCHEMBL10993528 0.79 GRM5 (0.58) GRM5L3MBTL1P2RX7TP53POLB

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-4542144-A EPILEPSY MCNEILAB INC. (US) 1985-09-17 — — US disclosed
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