SCHEMBL17276398

SCHEMBL17276398

O=C1CC(Sc2cccc(F)c2)N1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HAO1 Q9UJM8 1/20 0.36
CREBBP Q92793 1/20 0.36
DDB1 Q16531 4/20 0.35
CRBN Q96SW2 4/20 0.35
ALOX5 P09917 2/20 0.35
NOTUM Q6P988 1/20 0.35
KDM4E B2RXH2 1/20 0.35
IDO1 P14902 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RAB9A P51151 1/20 0.34
IKBKB O14920 1/20 0.34
FGFR1 P11362 1/20 0.34

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
SCHEMBL9261121 0.80 DDB1 (0.55) ALDH1A1MAPTCREBBPDDB1CRBN
SCHEMBL9251370 0.80 DDB1 (0.55) ALDH1A1GAAMAPTDDB1CRBN
SCHEMBL9253505 0.80 DDB1 (0.55) ALDH1A1POLBMAPTDDB1CRBN
SCHEMBL17276658 0.80 BRD4 (0.41) CREBBPDDB1CRBNALOX5NOTUM
SCHEMBL9256649 0.79 CRBN (0.51) GAACREBBPDDB1CRBN
SCHEMBL8522217 0.78 CRBN (0.47) ALDH1A1POLBGAAMAPTCREBBP
SCHEMBL11036165 0.78 CRBN (0.47) ALDH1A1POLBGAAMAPTCREBBP
SCHEMBL8439360 0.78 CRBN (0.47) ALDH1A1POLBGAAMAPTCREBBP
SCHEMBL17276561 0.78 DDB1 (0.55) CREBBPDDB1CRBNNOTUM
SCHEMBL8440828 0.76 DDB1 (0.58) ALDH1A1MAPTCREBBPDDB1CRBN

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
WO-2015179293-A1 SMALL MOLECULE ACTIVATORS AND INHIBITORS OF LECITHIN: CHOLESTEROL ACYLTRANSFERASE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2015-11-26 WO claimed