SCHEMBL7973057

SCHEMBL7973057

O=C1C=C(c2ccc(F)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
BCL2L1 Q07817 1/20 0.35
BAD Q92934 1/20 0.35
MAPK14 Q16539 1/20 0.35
PTGS1 P23219 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 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
SCHEMBL3519376 0.87 MAPK14 (0.41) HSD11B1MAPTALDH1A1MAPK14PTGS1
SCHEMBL7975852 0.78 PARP10 (0.42) PTGS1
SCHEMBL5228519 0.77 HTR2C (0.39) MAPTALDH1A1NPC1RAB9A
SCHEMBL728223 0.77 NPC1 (0.39) ALDH1A1HPGDHSD17B10NPC1RAB9A
SCHEMBL731336 0.76 NPC1 (0.50) MAPTHTTALDH1A1HPGDNPC1
SCHEMBL9081715 0.76 L3MBTL1 (0.39) ALDH1A1
SCHEMBL8706880 0.76 NCOA1 (0.44) NPC1
SCHEMBL6319811 0.74 ALDH1A1 (0.60) MAPTALDH1A1NPC1
SCHEMBL24924592 0.73 CYP11B1 (0.45) MAPTHTTMAPK14NPC1RAB9A
SCHEMBL20374588 0.72 NPC1 (0.70) MAPTALDH1A1HPGDPTGS1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6291520-B1 INHIBIT THE ENZYME LIPOXYGENASE; TREATMENT OR ALLEVIATION OF INFLAMMATORY DISEASES, ALLERGIC CONDITIONS AND CARDIOVASCULAR DISEASES PFIZER 2001-09-18 US disclosed
EP-0559743-B1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE PFIZER (US) 1995-03-08 EP disclosed
EP-0559743-A1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE. PFIZER HOSPITAL PROD (US) 1993-09-15 EP disclosed
WO-1992009566-A1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE PFIZER INC. (US) 1992-06-11 WO disclosed