SCHEMBL7922726

SCHEMBL7922726

Cc1ccc(-c2ccccc2/C=C/C#Cc2ccc(C(=O)Nc3ccc(O)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 1/20 0.47
NPC1 O15118 9/20 0.44
RAB9A P51151 9/20 0.44
MAPT P10636 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
POLB P06746 2/20 0.42
USP2 O75604 1/20 0.42
TP53 P04637 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
ESRRG P62508 1/20 0.39
PTPN1 P18031 1/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 2/20 0.38
NAMPT P43490 1/20 0.38

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
SCHEMBL7929272 0.86 BACE1 (0.39) MEN1KMT2APOLBPTPN1
SCHEMBL7922738 0.82 LMNA (0.40) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL1683992 0.82 RARB (0.53) MAPTSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL1683993 0.82 RARB (0.53) MAPTSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL8180152 0.81 CA1 (0.46) PTPN1HPGDLMNACYP2C9CYP2C19
SCHEMBL8167327 0.81 TDP1 (0.46) NPC1RAB9AMAPTSMN1; SMN2TP53
SCHEMBL7929252 0.81 RARB (0.43) MAPTLMNACYP2C9CYP2C19L3MBTL1
SCHEMBL8175175 0.81 RARB (0.43) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL7931791 0.81 BACE1 (0.44) RAB9AMAPTMEN1KMT2APTPN1
SCHEMBL7922760 0.77 RARA (0.37) NPC1RAB9AMAPTSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0879814-B1 Triaromatic compounds, compositions containing them and uses thereof CT INTERNAT DE BR RECH S DERMA (FR) 2001-11-28 EP claimed
US-6150413-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS; 4-(4-(BIPHENYL-2-YL)BUT-3-EN-1-YNYL)BENZOIC ACID, FOR EXAMPLE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2000-11-21 US claimed
EP-0879814-A1 Triaromatic compounds, compositions containing them and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-11-25 EP claimed
EP-0879814-B1 Triaromatic compounds, compositions containing them and uses thereof CT INTERNAT DE BR RECH S DERMA (FR) 2001-11-28 EP disclosed
US-6150413-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS; 4-(4-(BIPHENYL-2-YL)BUT-3-EN-1-YNYL)BENZOIC ACID, FOR EXAMPLE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2000-11-21 US disclosed
EP-0879814-A1 Triaromatic compounds, compositions containing them and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-11-25 EP disclosed