SCHEMBL7909638

SCHEMBL7909638

OCC1=CCC(Cl)(c2ccccc2)C=C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.33
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.30

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
SCHEMBL510772 0.74
Trichloroethane SCHEMBL28474125 0.68 GRIN2D (0.31)
SCHEMBL3391901 0.68
SCHEMBL6562524 0.67 CYP1A2 (0.39) OPRL1TSHR
SCHEMBL28677213 0.64 TSHR (0.41) OPRL1POLBTSHR
SCHEMBL7169862 0.61 MEN1 (0.33) POLBTSHR
SCHEMBL30968185 0.61
SCHEMBL28373094 0.60 CALM1 (0.38) OPRL1POLBTSHR
SCHEMBL23888569 0.58 MEN1 (0.41) OPRL1POLB
SCHEMBL7200662 0.56 HDAC4 (0.32)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6225352-B1 USEFUL AS AGENTS IN THE TREATMENT OF CANCER, ALZHEIMERS DISEASE, THROMBOSIS, INFLAMMATORY DISEASES, AND BACTERIAL RESISTANCE WARNER-LAMBERT COMPANY 2001-05-01 US disclosed
WO-1998006691-A2 LOW MOLECULAR WEIGHT DENDRITIC COMPOUNDS AS PHARMACEUTICAL AGENTS WARNER-LAMBERT COMPANY (US) 1998-02-19 WO disclosed