SCHEMBL7317640

SCHEMBL7317640

O=C(NCc1ccc(F)cc1)c1cccnc1Oc1ccc(F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.75
KMT2A Q03164 2/20 0.64
PTGER4 P35408 2/20 0.62
LMNA P02545 1/20 0.62
HPGD P15428 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
PTGER2 P43116 1/20 0.59

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
SCHEMBL7371983 0.95 MAPK8 (0.69) MAPK8KMT2APTGER4LMNAHPGD
SCHEMBL7168843 0.95 MAPK8 (0.72) MAPK8KMT2APTGER4
SCHEMBL7363675 0.94 MAPK8 (0.67) MAPK8KMT2APTGER4LMNAHPGD
SCHEMBL7371446 0.94 LMNA (0.72) MAPK8KMT2ALMNAHPGDSMN1; SMN2
SCHEMBL4087178 0.93 MAPK8 (0.69) MAPK8KMT2APTGER4LMNAHPGD
Hydrochloric Acid SCHEMBL6904217 0.93 MAPK8 (0.66) MAPK8KMT2APTGER4LMNAHPGD
SCHEMBL7368852 0.92 MAPK8 (0.65) MAPK8PTGER4LMNAHPGDSMN1; SMN2
SCHEMBL7365751 0.92 MAPK8 (0.67) MAPK8KMT2APTGER4
SCHEMBL4086210 0.91 MAPK8 (0.64) MAPK8KMT2APTGER4LMNAHPGD
SCHEMBL4081701 0.91 MAPK8 (0.64) MAPK8KMT2APTGER4LMNAHPGD

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
EP-0357316-B1 ANTIDEPRESSANT N-SUBSTITUTED NICOTINAMIDE COMPOUNDS PFIZER INC. (US) 1993-04-14 EP disclosed
EP-0357316-A1 Antidepressant N-substituted nicotinamide compounds PFIZER INC. (US) 1990-03-07 EP disclosed
US-4861891-A Antidepressant N-substituted nicotinamide compounds PFIZER INC. (US) 1989-08-29 US disclosed