SCHEMBL10659227

SCHEMBL10659227

O=C(COc1ccc2c(-c3ccccc3F)noc2c1Cl)NO

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ FHIT P49789 6/20 0.39
▸ FFAR4 Q5NUL3 1/20 0.38
▸ ALOX15 P16050 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ KCNJ6 P48051 1/20 0.37
▸ KCNJ3 P48549 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ SMPD1 P17405 1/20 0.37
▸ SENP2 Q9HC62 1/20 0.37
▸ SENP1 Q9P0U3 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ GPBAR1 Q8TDU6 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ PTGS1 P23219 1/20 0.35

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
SCHEMBL10663342 0.91 PKM (0.43) TP53POLBRXFP1FFAR4ALOX15
SCHEMBL10659946 0.88 FHIT (0.48) POLBRXFP1FHITALOX15SMN1; SMN2
SCHEMBL10657284 0.88 FFAR4 (0.40) TP53POLBRXFP1FFAR4TSHR
SCHEMBL4035353 0.88 FFAR4 (0.44) FFAR4GPBAR1HPGDPTGS1
SCHEMBL10735991 0.87 FFAR4 (0.34) TP53POLBRXFP1FFAR4SMPD1
SCHEMBL10660670 0.87 TP53 (0.36) TP53POLBRXFP1FFAR4ALOX15
SCHEMBL10661727 0.87 CASP1 (0.44) FFAR4SMPD1GPBAR1PTGS1
SCHEMBL10658060 0.84 ALDH1A1 (0.42) FFAR4TSHRSMN1; SMN2MAPTGPBAR1
SCHEMBL10662256 0.83 ALDH1A1 (0.44) POLBFFAR4TSHRSMN1; SMN2MEN1
SCHEMBL10662964 0.82 TSHR (0.43) FFAR4TSHRSMN1; SMN2MAPTGPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4673746-A DIURETICS, HYPOTENSIVES HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1987-06-16 — — US claimed
US-4728662-A DIURETICS, URICOSURICS, HYPOTENSIVES HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-03-01 — — US disclosed
US-4673746-A DIURETICS, HYPOTENSIVES HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1987-06-16 — — US disclosed
Send feedback