SCHEMBL8995501

SCHEMBL8995501

ClC(CBr)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
HTR2A P28223 3/20 0.40
TAAR1 Q96RJ0 2/20 0.40
DPP4 P27487 2/20 0.38
TRPA1 O75762 2/20 0.38
ALDH1A1 P00352 1/20 0.38
F2 P00734 1/20 0.38
HRH1 P35367 2/20 0.37
MTOR P42345 1/20 0.37
RAB9A P51151 1/20 0.37
GRM7 Q14831 1/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 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
SCHEMBL31173889 0.86 CHRNB2 (0.47) TSHRTAAR1ALDH1A1LMNACYP3A4
SCHEMBL8110947 0.80 TSHR (0.46) TSHRHTR2ATAAR1DPP4TRPA1
SCHEMBL564025 0.79 TSHR (0.50) TSHRHTR2ATAAR1DPP4F2
SCHEMBL9425022 0.78 TSHR (0.55) TSHRHTR2ATAAR1DPP4TRPA1
SCHEMBL22042229 0.78 TSHR (0.55) TSHRHTR2ATAAR1DPP4F2
SCHEMBL28858478 0.77 TSHR (0.48) TSHRLMNACYP3A4
SCHEMBL28858569 0.77 HTR2A (0.40) HTR2AALDH1A1ALOX15
SCHEMBL8110499 0.77 TSHR (0.42) TSHRHTR2ATAAR1DPP4TRPA1
SCHEMBL138020 0.76 TSHR (0.52) TSHRHTR2ATAAR1DPP4F2
SCHEMBL31173879 0.75 CHRNA7 (0.39) TSHRALDH1A1RAB9ALMNA

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-1137788-A Process for making polyphenols from ketones or aldehydes and phenols DOW CHEMICAL CO (US) 1996-12-11 CN claimed
EP-0725771-A1 PROCESS FOR MAKING POLYPHENOLS FROM KETONES OR ALDEHYDES AND PHENOLS THE DOW CHEMICAL COMPANY (US) 1996-08-14 EP claimed
WO-1996006819-A1 PROCESS FOR MAKING POLYPHENOLS FROM KETONES OR ALDEHYDES AND PHENOLS THE DOW CHEMICAL COMPANY (US) 1996-03-07 WO claimed
CN-119061410-A Method for electrochemically synthesizing chlorobromide 中国科学院大连化学物理研究所 2024-12-03 CN disclosed
CN-115197046-B Halogenation method of unsaturated hydrocarbon 华南理工大学 2023-12-15 CN disclosed
CN-115197046-A Halogenation method of unsaturated hydrocarbon 华南理工大学 2022-10-18 CN disclosed
US-20110313196-A1 NOVEL PROCESS HOFFMANN-LA ROCHE, INC. 2011-12-22 US disclosed
CN-1856499-A New 2-substituted, 4-amino-thiazolo[4,5-d] pyrimidines, useful as chemokine receptor antagonists, esp. cx3cr1 ASTRAZENECA AB (SE) 2006-11-01 CN disclosed
CN-1200105-A Isomerization of bisphenols DOW CHEMICAL CO (US) 1998-11-25 CN 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-20110313196-A1 NOVEL PROCESS CYP3A5, CYP3A4, GBA1 TSHR 2563/4885HTR2A 1039/4885TAAR1 3928/4885

“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.