SCHEMBL9645227

SCHEMBL9645227

O=C1NCCN(c2cccc(OCc3ccccc3)c2)N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 1.00
GRM5 P41594 1/20 0.52

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
SCHEMBL10749567 0.82 ALOX5 (0.70) ALOX5GRM5
SCHEMBL29508690 0.81 ALOX5 (0.67) ALOX5GRM5
SCHEMBL22750386 0.81 ALOX5 (0.67) ALOX5GRM5
SCHEMBL6009938 0.78 ALOX5 (1.00) ALOX5
SCHEMBL9645445 0.78 ALOX5 (0.68) ALOX5
SCHEMBL3977885 0.74 ALOX5 (0.59) ALOX5GRM5
SCHEMBL9779946 0.74 ALOX5 (0.59) ALOX5GRM5
SCHEMBL4671546 0.73 ADRB1 (0.59) ALOX5GRM5
SCHEMBL5737605 0.73 GRM5 (0.59) ALOX5GRM5
SCHEMBL9645332 0.73 ALOX5 (0.70) ALOX5

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-5086052-A Antiarthritic, antiallergens, antiinflammatory agents; also for asthma and psoriasis ABBOTT LABORATORIES (US) 1992-02-04 US disclosed
US-4970210-A ENZYME INHIBITORS ABBOTT LABORATORIES (US) 1990-11-13 US disclosed