SCHEMBL95478

SCHEMBL95478

O=[C]c1cc(Cl)ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.48
TSHR P16473 7/20 0.42
TDP1 Q9NUW8 4/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 3/20 0.42
HSD17B10 Q99714 2/20 0.42
CASP1 P29466 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
S100A4 P26447 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
MAPK1 P28482 3/20 0.35
MCL1 Q07820 1/20 0.34
VCAM1 P19320 1/20 0.34
PTPN11 Q06124 1/20 0.34

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
SCHEMBL11507070 0.82 VCAM1 (0.39) TP53TSHRTDP1ALDH1A1CYP3A4
SCHEMBL95434 0.80 TP53 (0.48) TP53TSHRTDP1ALDH1A1CYP3A4
SCHEMBL27613550 0.78 PTGDR2 (0.40) TP53TSHRTDP1ALDH1A1CYP3A4
SCHEMBL6897410 0.76 ALDH1A1 (0.40) TDP1ALDH1A1MEN1POLBKMT2A
SCHEMBL28759368 0.76 S100A4 (0.38) TP53TSHRTDP1ALDH1A1CYP3A4
SCHEMBL27623468 0.76 CYP3A4 (0.52) TP53TSHRTDP1ALDH1A1CYP3A4
SCHEMBL5163990 0.76 HSD17B10 (0.50) TSHRTDP1ALDH1A1CYP3A4HSD17B10
SCHEMBL2490883 0.76 MAPK1 (0.38) TDP1MAPK1VCAM1
SCHEMBL21201419 0.76 CYP3A4 (0.46) TP53ALDH1A1CYP3A4SMN1; SMN2POLB
SCHEMBL6212276 0.76 PTGDR2 (0.36) TDP1ALDH1A1PTGDR2MAPK1VCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4399212-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-07-17 EP claimed
CN-118159542-A Substituted 2, 3-dihydro [1,3] thiazolo [4,5-b ] pyridines, salts thereof and their use as herbicidal agents 拜耳公司 2024-06-07 CN claimed
WO-2023036707-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2023-03-16 WO claimed
CN-111499654-B Method for synthesizing 3-chloro-thiophene [2, 3-b ] pyridine derivative 南通诺泰生物医药技术有限公司 2022-09-02 CN claimed
EP-3672978-B1 PROCESS FOR MAKING IXAZOMIB AND ITS INTERMEDIATES SYNTHON BV (NL) 2021-10-06 EP claimed
CN-111499654-A Method for synthesizing 3-chloro-thiophene [2, 3-b ] pyridine derivative 南通诺泰生物医药技术有限公司 2020-08-07 CN claimed
EP-3672978-A1 PROCESS FOR MAKING IXAZOMIB OR INTERMEDIATES THEREFOR Synthon B.V. (NL) 2020-07-01 EP claimed
US-20200199159-A1 PROCESS FOR MAKING IXAZOMIB OR INTERMEDIATES THEREFOR SYNTHON B.V. (NL) 2020-06-25 US claimed
WO-2019038406-A1 PROCESS FOR MAKING IXAZOMIB OR INTERMEDIATES THEREFOR SYNTHON B.V. (NL) 2019-02-28 WO claimed
CN-107311859-A A kind of efficient chlorobenzoyl chloride chlorination coproduction m-chlorobenzoyl chloride and 2, the method for 5 dichlorobenzoyl chlorides 江苏万隆化学有限公司 2017-11-03 CN claimed
US-6150378-A 1-((1-HALO-SUBSTITUTEDBENZOYLAMINO)-2-PHENYLETHYL)-CARBONYL -CARBONYLAMINO),2-PHENYL OR PYRID-2-YLSULFAMIDO)ETHANE DERIVATIVES; MUSCULAR DYSTROPHY, NEURODEGENERATION, STROKE, ALZHEIMER'S, AMYOTROPHY, MOTOR NEURON DAMAGE, CNS INJURY CEPHALON, INC. (US) 2000-11-21 US claimed
EP-0983507-A1 TRICYCLIC TETRAHYDROQUINOLINE DERIVATIVES AND TRICYCLIC TETRAHYDROQUINOLINE COMBINATORIAL LIBRARIES Trega Biosciences, Inc. (US) 2000-03-08 EP claimed
EP-0977989-A1 4-SUBSTITUTED-QUINOLINE DERIVATIVES AND 4-SUBSTITUTE-QUINOLINE COMBINATORIAL LIBRARIES TREGA BIOSCIENCES, INC. (US) 2000-02-09 EP claimed
WO-1998034115-A1 4-SUBSTITUTED-QUINOLINE DERIVATIVES AND 4-SUBSTITUTE-QUINOLINE COMBINATORIAL LIBRARIES TREGA BIOSCIENCES, INC. (US) 1998-08-06 WO claimed
WO-1998034111-A1 TRICYCLIC TETRAHYDROQUINOLINE DERIVATIVES AND TRICYCLIC TETRAHYDROQUINOLINE COMBINATORIAL LIBRARIES TREGA BIOSCIENCES, INC. (US) 1998-08-06 WO claimed
EP-0560268-B1 Substituted pipecolinic acid derivatives as HIV protease inhibitors BIO MEGA BOEHRINGER INGELHEIM (CA) 1995-01-04 EP claimed
WO-1993018003-A1 SUBSTITUED PIPECOLINIC ACID DERIVATIVES AS HIV PROTEASE INHIBITORS BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-16 WO claimed
EP-0560268-A1 Substituted pipecolinic acid derivatives as HIV protease inhibitors BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-15 EP claimed
US-5049551-A Antitumor UBE INDUSTRIES, LTD. (JP) 1991-09-17 US claimed
EP-0400610-A1 5-Fluorouracil derivatives UBE INDUSTRIES, LTD. (JP) 1990-12-05 EP claimed

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-20200199159-A1 PROCESS FOR MAKING IXAZOMIB OR INTERMEDIATES THEREFOR GLP1R, CDK11B, GIPR TP53 2051/4885TSHR 329/4885TDP1 1506/4885

“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.