SCHEMBL8747477

SCHEMBL8747477

Cc1cccc(S)c1S.[Ni]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.43
CYP1A2 P05177 2/20 0.43
ACHE P22303 2/20 0.42
TSHR P16473 2/20 0.42
ALDH1A1 P00352 4/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
PSMD14 O00487 2/20 0.40
COPS5 Q92905 2/20 0.40
TRPA1 O75762 2/20 0.36
CD44 P16070 1/20 0.36
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.33
ESR1 P03372 1/20 0.33
SCN4A P35499 3/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 1/20 0.32
LMNA P02545 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
SCHEMBL29649153 1.00
SCHEMBL467333 1.00
SCHEMBL623762 0.97 CYP2A6 (0.41) CYP2A6CYP1A2ACHETSHRALDH1A1
SCHEMBL191201 0.84
Phenol SCHEMBL10537757 0.84 CA12 (0.46) CYP1A2ACHETSHRALDH1A1CA1
SCHEMBL7735306 0.81 CYP1A2 (0.47) CYP2A6CYP1A2ACHETSHRALDH1A1
Isobutane SCHEMBL28911841 0.80 CYP1A2 (0.41) CYP2A6CYP1A2ACHETSHRALDH1A1
SCHEMBL332474 0.77
SCHEMBL21520 0.77
SCHEMBL30548743 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5612279-A REVERSIBILITY NIPPON PAPER INDUSTRIES, LTD. (JP) 1997-03-18 US disclosed
EP-0676298-B1 Transparent recording medium and process for its production JUJO PAPER CO LTD (JP) 1997-03-05 EP disclosed
EP-0520404-B1 Transparent recording medium JUJO PAPER CO LTD (JP) 1996-09-11 EP disclosed
US-5470816-A Urea developers NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1995-11-28 US disclosed
EP-0676298-A1 Transparent recording medium and process for its production NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1995-10-11 EP disclosed
US-5434119-A TRANSPORT RECORDING LAYER COMPRISING DEVELOPER FORMED BY BLOCKING HYDROXYL GROUP WITH DEVELOPING FUNCTION JUJO PAPER CO., LTD. (JP) 1995-07-18 US disclosed
EP-0520404-A1 Transparent recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1992-12-30 EP disclosed