SCHEMBL8435658

SCHEMBL8435658

CC(Cc1noc(C(F)F)n1)C(CO)NC(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
TRPM8 Q7Z2W7 1/20 0.42
TACR1 P25103 1/20 0.40
CTRB1 P17538 2/20 0.40
CTSK P43235 1/20 0.39

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
SCHEMBL8437488 0.90 ATM (0.45) ATMTRPM8TACR1CTRB1
SCHEMBL8436584 0.87 ATM (0.47) ATMTRPM8CTRB1CTSK
SCHEMBL8435719 0.85 HDAC6 (0.44) ATMTRPM8CTRB1CTSK
SCHEMBL8434719 0.85 PRSS1 (0.51) ATMTRPM8CTRB1
SCHEMBL8433202 0.85 TACR1 (0.48) ATMTRPM8TACR1CTRB1CTSK
SCHEMBL8435708 0.84 ATM (0.45) ATMTRPM8CTRB1CTSK
SCHEMBL8433716 0.83 ATM (0.43) ATMTRPM8CTRB1
SCHEMBL8438342 0.82 ATM (0.43) ATMTRPM8CTRB1
SCHEMBL8437901 0.82 PRSS1 (0.44) ATMTRPM8
SCHEMBL8437487 0.80 PRSS1 (0.56) ATMCTSK

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-5874585-A TREATMENT AND/OR PREVENTION OF ELASTASE-MEDIATED PROBLEMS SUCH AS ARTHRITIS, PERIODONTAL DISEASE, GLOMERULONEPHRITIS, DERMATITIS, PSORIASIS, CYSTIC FIBROSIS, CHRONIC BRONCHITIS, ALZHEIMER'S DISEASE CORTECH, INC. (US) 1999-02-23 US disclosed