SCHEMBL3203278

SCHEMBL3203278

OCCC(S)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.48
HRH1 P35367 3/20 0.39
LMNA P02545 1/20 0.38
HTR2A P28223 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RIPK1 Q13546 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP2D6 P10635 1/20 0.36
SRC P12931 1/20 0.36

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
SCHEMBL9323529 0.87 TRPA1 (0.34) TRPA1
SCHEMBL8443421 0.85 HRH1 (0.46) HRH1HTR2ATDP1TAAR1
SCHEMBL6401479 0.80 TRPA1 (0.45) TRPA1LMNAHTR2ATAAR1KDM4E
SCHEMBL19632871 0.80 TRPA1 (0.45) TRPA1LMNAHTR2ATAAR1KDM4E
SCHEMBL1408602 0.80 TRPA1 (0.45) TRPA1LMNAHTR2ATAAR1KDM4E
Ethylene Glycol SCHEMBL3192561 0.80 CYP2D6 (0.44) KDM4EALDH1A1CYP2D6SRC
SCHEMBL25221462 0.77 HTR2A (0.36) HRH1LMNAHTR2ACYP2D6
SCHEMBL10352116 0.77 SLC6A2 (0.37) LMNAKDM4E
SCHEMBL9860787 0.77 HRH1 (0.39) HRH1LMNAHTR2ATAAR1KDM4E
SCHEMBL128570 0.77 HRH1 (0.56) TRPA1HRH1LMNAHTR2ATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114402096-A Composition for tin-silver alloy electroplating comprising complexing agent 巴斯夫欧洲公司 2022-04-26 CN disclosed
US-20100029876-A1 POLYMERIZATION ACCELERATOR, CURABLE COMPOSITION, CURED PRODUCT, AND PROCESS FOR PRODUCING THIOL COMPOUND SHOWA DENKO K.K. (JP) 2010-02-04 US disclosed
EP-2030989-A1 POLYMERIZATION ACCELERATOR, CURABLE COMPOSITION, CURED PRODUCT AND METHOD FOR PRODUCING THIOL COMPOUND Showa Denko K.K. (JP) 2009-03-04 EP disclosed
US-5403502-A Lubricating additive comprising a molybdenum (VI) hydroxymercaptide PHILLIPS PETROLEUM COMPANY (US) 1995-04-04 US disclosed
US-5169819-A Impregnation of supported catalyst with aqueous ammonium sulfide solution which also contains sulfur-compound adjuvants then controlled heating EUROPEENNE DE RETRAITEMENT DE CATALYSEURS (FR) 1992-12-08 US disclosed
US-4729839-A THIO ESTER-ETHERS, ESTERIFICATION, ETHERIFICATION PHILLIPS PETROLEUM COMPANY (US) 1988-03-08 US disclosed
EP-0249783-A1 Water soluble lubricating additives PHILLIPS PETROLEUM COMPANY (US) 1987-12-23 EP disclosed
US-4636487-A Process for the preparation of promoted catalysts PHILLIPS PETROLEUM COMPANY (US) 1987-01-13 US disclosed
US-4582594-A MERCAPTO ALCOHOL AND MOLYBDENUM COMPOUND REACTION PRODUCT ACTIVATING HYDROREFINING CATALYST PHILLIPS PETROLEUM COMPANY (US) 1986-04-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100029876-A1 POLYMERIZATION ACCELERATOR, CURABLE COMPOSITION, CURED PRODUCT, AND PROCESS FOR PRODUCING THIOL COMPOUND TMT1A, CCNT1, MGMT TRPA1 966/4885HRH1 1842/4885LMNA 3457/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.