SCHEMBL7263260

SCHEMBL7263260

CC1=C(C)C(=O)C(Nc2nc(C)cc(C)n2)=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ NPC1 O15118 4/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ MAPT P10636 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ TSHR P16473 1/20 0.36

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
SCHEMBL7270260 0.78 RAB9A (0.55) LMNAGAANPC1RAB9AMAPT
SCHEMBL22853792 0.70 LMNA (0.64) LMNAGAANPC1RAB9AMAPT
SCHEMBL9333371 0.68 MAPT (0.61) LMNANPC1RAB9AMAPTKDM4E
SCHEMBL9904759 0.61 TAAR1 (0.58) GAANPC1RAB9AMAPTKDM4E
SCHEMBL2914660 0.59 TSHR (0.56) LMNAGAAMAPTKDM4EALDH1A1
SCHEMBL3266109 0.58 MAPT (0.53) LMNAGAAMAPTKDM4EALDH1A1
SCHEMBL22805 0.58 MAPT (0.46) LMNAGAANPC1RAB9AMAPT
SCHEMBL22628619 0.58 RAB9A (0.65) LMNAGAANPC1RAB9AMAPT
SCHEMBL12038996 0.58 TSHR (0.55) LMNAGAAMAPTKDM4EALDH1A1
Pyrimethanil SCHEMBL20817 0.58 SMN1; SMN2 (0.71) LMNAGAANPC1RAB9AMAPT

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
US-6653311-B1 Minimal or no effect on cycloxygenase-1 and -2 activity BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY 2003-11-25 — — US claimed
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