SCHEMBL7537640

SCHEMBL7537640

CCC(C)c1cc(C(C)(C)C)cc(-n2nc3ccc(SC)cc3n2)c1O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.37
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL3191876 0.88 RORC (0.44) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL78803 0.85 NPC1 (0.45) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL29463599 0.85 NPC1 (0.45) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL5447098 0.85 RORC (0.39) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL708739 0.84 RORC (0.40) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL11416372 0.83 RORC (0.37) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL713026 0.82 RORC (0.40) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL29706556 0.81 RORC (0.36) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL6454940 0.81 RORC (0.36) RORCCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL29706624 0.81 RORC (0.35) RORCCYP1A2CYP3A4CYP2C9TSHR

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-0576527-B1 5-THIO-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS CIBA SC HOLDING AG (CH) 2002-05-22 EP disclosed
US-5942626-A REACTING A 5-HALO-SUBSTITUTED BENZOTRIAZOLE WITH A MERCAPTO COMPOUND IN THE PRESENCE OF A GROUP 1A METAL OR GROUP 2A COMPOUND FORMING 5-THIO-SUBSTITUTED 2H-BENZOTRIAZOLES HAVING ENHANCED ABSORBANCE AT LONGER WAVELENGTHS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-24 US disclosed
US-5516914-A Compositions stabilized with 5-thio-substituted benzotriazole UV-absorbers CIBA-GEIGY CORPORATION (US) 1996-05-14 US disclosed
US-5278314-A N-Phenol-substituted benzotriazoles CIBA-GEIGY CORPORATION (US) 1994-01-11 US disclosed
EP-0576527-A1 5-THIO-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS Ciba SC Holding AG (CH) 1994-01-05 EP disclosed
WO-1992014718-A1 5-THIO-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS CIBA-GEIGY AG (CH) 1992-09-03 WO disclosed