SCHEMBL17017263

SCHEMBL17017263

Oc1cc(S)c(Cl)cc1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA3 P07451 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
TSHR P16473 5/20 0.35
HSD17B10 Q99714 5/20 0.35
HPGD P15428 4/20 0.35
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
CYP3A4 P08684 2/20 0.32
HSP90AA1 P07900 1/20 0.32
ESR1 P03372 3/20 0.32
ESR2 Q92731 3/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
PYGL P06737 1/20 0.30

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
SCHEMBL15149919 0.79 HSD17B10 (0.48) TSHRHSD17B10HPGDCYP3A4HSP90AA1
SCHEMBL26649343 0.79 HSD17B10 (0.55) CA3CA6CA5ACA9CA14
SCHEMBL28098981 0.77 CA3 (0.40) CA3CA6CA5ACA9CA14
SCHEMBL29940963 0.77 CA3 (0.40) CA3CA6CA5ACA9CA14
SCHEMBL13623675 0.77 HSD17B10 (0.60) TSHRHSD17B10HPGDCYP3A4HSP90AA1
SCHEMBL26978765 0.75
SCHEMBL4340005 0.73 HTR3E (0.42) CA3CA6CA5ACA9CA14
SCHEMBL5635675 0.72 HSD17B10 (0.60) TSHRHSD17B10HPGDCYP3A4HSP90AA1
SCHEMBL23706575 0.71 AHR (0.39) CA3CA6CA5ACA9CA14
SCHEMBL7798913 0.71 GAA (0.38) CA9TSHRCYP3A4ALDH1A1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114478336-B Process for producing mercaptophenol compound and intermediate therefor 组合化学工业株式会社 2024-05-14 CN disclosed
EP-3760613-B1 METHOD FOR PRODUCING MERCAPTOPHENOL COMPOUND AND INTERMEDIATE OF SAID COMPOUND KUMIAI CHEMICAL INDUSTRY CO (JP) 2023-01-25 EP disclosed
EP-3760613-B1 METHOD FOR PRODUCING MERCAPTOPHENOL COMPOUND AND INTERMEDIATE OF SAID COMPOUND KUMIAI CHEMICAL INDUSTRY CO (JP) 2023-01-25 EP disclosed
CN-114478336-A Process for producing mercaptophenol compound and intermediate therefor 组合化学工业株式会社 2022-05-13 CN disclosed
CN-111918862-B Process for producing mercaptophenol compound and intermediate therefor 组合化学工业株式会社 2022-01-18 CN disclosed
EP-3162799-B1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2021-03-10 EP disclosed
EP-3162799-B1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2021-03-10 EP disclosed
EP-3760613-A1 METHOD FOR PRODUCING MERCAPTOPHENOL COMPOUND AND INTERMEDIATE OF SAID COMPOUND Kumiai Chemical Industry Co., Ltd. (JP) 2021-01-06 EP disclosed
EP-3760613-A1 METHOD FOR PRODUCING MERCAPTOPHENOL COMPOUND AND INTERMEDIATE OF SAID COMPOUND Kumiai Chemical Industry Co., Ltd. (JP) 2021-01-06 EP disclosed
US-10851052-B2 Method for producing mercaptophenol compound and intermediate of said compound KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2020-12-01 US disclosed
US-20190233380-A1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-08-01 US disclosed
US-10308613-B2 Fluoroalkylating agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-06-04 US disclosed
US-10308613-B2 Fluoroalkylating agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-06-04 US disclosed
US-20170197920-A1 FLUOROALKYLATING AGENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2017-07-13 US disclosed
US-20170197920-A1 FLUOROALKYLATING AGENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2017-07-13 US disclosed
US-20170197920-A1 FLUOROALKYLATING AGENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2017-07-13 US disclosed
EP-3162799-A1 FLUOROALKYLATING AGENT Ihara Chemical Industry Co., Ltd. (JP) 2017-05-03 EP disclosed
EP-3162799-A1 FLUOROALKYLATING AGENT Ihara Chemical Industry Co., Ltd. (JP) 2017-05-03 EP disclosed
WO-2015199109-A1 FLUOROALKYLATING AGENT イハラケミカル工業株式会社 2015-12-30 WO disclosed
WO-2015122396-A1 METHOD FOR PRODUCING HARMFUL-ORGANISM CONTROL AGENT, AND INTERMEDIATE THEREOF イハラケミカル工業株式会社 2015-08-20 WO 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 (4 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-10308613-B2 Fluoroalkylating agent AFF1, AFF4, AFF2 CA3 1555/4885CA6 841/4885CA5A 3083/4885
US-10851052-B2 Method for producing mercaptophenol compound and intermediate of said compound MGMT, MPST, TPMT CA3 585/4885CA6 134/4885CA5A 629/4885
US-20190233380-A1 FLUOROALKYLATING AGENT AFF1, AFF4, AFF2 CA3 1555/4885CA6 841/4885CA5A 3083/4885
US-20170197920-A1 FLUOROALKYLATING AGENT AFF1, AFF4, AFF2 CA3 1555/4885CA6 841/4885CA5A 3083/4885

“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.