SCHEMBL135987

SCHEMBL135987

c1ccc2c(P(c3cccc4ccccc34)c3cccc4ccccc34)cccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
HSD17B10 Q99714 6/20 0.50
TSHR P16473 4/20 0.50
CYP2A6 P11509 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP1A2 P05177 5/20 0.46
HPGD P15428 3/20 0.46
CYP3A4 P08684 2/20 0.46
KEAP1 Q14145 1/20 0.46
HPRT1 P00492 1/20 0.46
HIF1A Q16665 1/20 0.42
CYP1B1 Q16678 1/20 0.42
THRB P10828 1/20 0.42
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
NR4A1 P22736 1/20 0.39
NR4A2 P43354 1/20 0.39
NR4A3 Q92570 1/20 0.39
CA9 Q16790 2/20 0.39
CA12 O43570 1/20 0.39

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
SCHEMBL29390280 1.00 ALDH1A1 (0.50) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL11861469 0.97 ALDH1A1 (0.48) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL11826715 0.97 ALDH1A1 (0.48) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL15658735 0.97 ALDH1A1 (0.48) ALDH1A1HSD17B10TSHRCYP2A6TDP1
Hydrochloric Acid SCHEMBL11831311 0.95 ALDH1A1 (0.46) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL15658102 0.91 ALDH1A1 (0.42) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL15658738 0.87 ALDH1A1 (0.43) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL5680525 0.87 ALDH1A1 (0.39) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL11889449 0.87 ALDH1A1 (0.48) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL6230319 0.87 ALDH1A1 (0.39) ALDH1A1HSD17B10TSHRCYP2A6TDP1

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

Appears in 2208 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119707617-A Method for reducing alkyne into alkene by using water as hydrogen source 长春工业大学 2025-03-28 CN claimed
CN-118878402-A Preparation method of trifluoromethyl ketone compound based on palladium catalysis of C-N bond cleavage 大连理工大学 2024-11-01 CN claimed
US-12090473-B2 Catalyst compositions and hydroformylation processes DOW TECHNOLOGY INVESTMENTS LLC (US) 2024-09-17 US claimed
CN-118388585-A Preparation method of amide and ester compounds based on visible light catalysis 泰山学院 2024-07-26 CN claimed
CN-117460762-A Polymer for electronic device 杜邦电子公司 2024-01-26 CN claimed
US-11591467-B2 Thermoplastic polymer composites and methods for preparing, collecting, and tempering 3D printable materials and articles from same G6 MATERIALS CORP. (US) 2023-02-28 US claimed
CN-111689847-B Preparation method of aryl propionic acid compound 浙江新和成股份有限公司 2022-05-17 CN claimed
CN-114478632-A Spiro-dihydrobenzothiole diphosphine compound, and preparation method and application thereof 中国科学院上海有机化学研究所 2022-05-13 CN claimed
CN-110357989-B Tertiary amine photosensitizer, preparation method thereof, photosensitive resin composition containing tertiary amine photosensitizer and application of photosensitive resin composition 常州强力电子新材料股份有限公司 2022-04-22 CN claimed
EP-2981560-B1 CURING OF LIQUID THERMOSETTING RESINS REICHHOLD LLC 2 (US) 2021-10-13 EP claimed
US-4400547-A LIGANDIZING REACTOR EFFLUENT TO PREVENT CATALYST LOSS THROUGH PLATING EASTMAN KODAK COMPANY (US) 1983-08-23 US claimed
US-4400499-A OXIDATIVE COUPLING UNION CARBIDE CORPORATION (US) 1983-08-23 US claimed
EP-0085185-A1 Integrated process for the preparation of substantially linear high molecular weight thermoplastic polymers from aryl polyhalide monomers AMOCO CORPORATION (US) 1983-08-10 EP claimed
EP-0055887-A2 Novel catalyst system and process for producing ethanol using said novel catalyst system GULF RESEARCH & DEVELOPMENT COMPANY (US) 1982-07-14 EP claimed
US-4306087-A RHODIUM-DIPHOSPHINO COMPLEX CATALYST KURARAY CO., LTD. (JP) 1981-12-15 US claimed
US-4250063-A COORDINATION CATALYST COMPRISING AN ORGANIC COMPLEX OF TUNGSTEN OR MOLYBDENUM, A TITANIUM TETRAHALIDE, AND AN N-HALO IMIDE, A SULFIDE, A SULFOXIDE, OR A PHOSPHINE; POLYALKENAMERS JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1981-02-10 US claimed
US-4215077-A RHODIUM CARBONYL COMPLEX CATALYST AND A DIPHOSPINOALKANE ADDITIVE KURARAY CO., LTD. (JP) 1980-07-29 US claimed
EP-0013464-A1 Selective formation of ethanol from methanol, hydrogen and carbon monoxide GULF RESEARCH & DEVELOPMENT COMPANY (US) 1980-07-23 EP claimed
US-4133966-A SELECTIVE CATALYST SYSTEM OF COBALT ACETYLACETONATE, GROUP VA ORGAN/COMPOUND, IODINE PROMOTER AND RUTHENIUM COMPOUND PROMOTER GULF RESEARCH & DEVELOPMENT COMPANY (US) 1979-01-09 US claimed
US-4108905-A CATALYTIC HYDROFORMYLATION OF PROPYLENE TO FORM BUTYRALDEHYDE JOHNSON, MATTHEY & CO., LIMITED (GB) 1978-08-22 US claimed