SCHEMBL7529007

SCHEMBL7529007

CC(C)(C)c1ccc2ccccc2c1[S]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.44
ALDH1A1 P00352 5/20 0.44
TSHR P16473 4/20 0.44
CYP2A6 P11509 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
HPRT1 P00492 1/20 0.41
CYP1A2 P05177 2/20 0.39
HIF1A Q16665 3/20 0.38
CYP1B1 Q16678 1/20 0.38
HPGD P15428 3/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SIGMAR1 Q99720 1/20 0.37
MAPT P10636 2/20 0.37
ATM Q13315 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
GLA P06280 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL1644210 0.79 HSD17B10 (0.44) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL1906196 0.78 HSD17B10 (0.48) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL4124570 0.77 HSD17B10 (0.46) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL2873052 0.77 TSHR (0.56) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL9624177 0.75 HSD17B10 (0.44) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL4630970 0.75 HSD17B10 (0.44) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL19798864 0.75 HSD17B10 (0.44) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL15910482 0.75 HSD17B10 (0.44) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL2220947 0.75 HSD17B10 (0.59) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL15910481 0.75 HSD17B10 (0.44) HSD17B10ALDH1A1TSHRCYP2A6TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113711113-A Optical material, polymerizable composition for optical material, plastic lens, eyewear, infrared sensor, and infrared camera 三井化学株式会社 2021-11-26 CN disclosed
EP-0928816-B1 Phthalocyanine compound, its intermediate, process for producing the compound, and use thereof YAMAMOTO CHEMICALS INC (JP) 2002-03-06 EP disclosed
US-6093832-A NEAR INFRARED RAY ABSORBING MATERIAL OR A LIGHT-HEAT CONVERSION MATERIAL YAMAMOTO CHEMICALS, INC. (JP) 2000-07-25 US disclosed
US-5973140-A Phthalocyanine compound, its intermediate, process for producing the compound, and use thereof YAMAMOTO CHEMICALS, INC (JP) 1999-10-26 US disclosed
EP-0928816-A2 Phthalocyanine compound, its intermediate, process for producing the compound, and use thereof Yamamoto Chemicals, Inc. (JP) 1999-07-14 EP disclosed