SCHEMBL921287

SCHEMBL921287

Cc1ccc(C(=O)Cl)c(Cl)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.54
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
POLB P06746 1/20 0.40
ACLY P53396 1/20 0.38
DHODH Q02127 2/20 0.38
PARP1 P09874 1/20 0.37
BRD4 O60885 1/20 0.36
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
SORT1 Q99523 1/20 0.35
CCR1 P32246 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
SCHEMBL846877 0.83 EGFR (0.50) EGFRSMN1; SMN2ALDH1A1MAPK1POLB
SCHEMBL400674 0.83 EGFR (0.54) EGFRSMN1; SMN2ALDH1A1MAPK1ACLY
Hydrochloric Acid SCHEMBL921288 0.82 EGFR (0.53) EGFRSMN1; SMN2ALDH1A1MAPK1ACLY
SCHEMBL5190356 0.82 POLB (0.52) EGFRSMN1; SMN2ALDH1A1MAPK1POLB
SCHEMBL13952836 0.81 GABRP (0.42) EGFRSMN1; SMN2ALDH1A1ACLYPARP1
Hydrochloric Acid SCHEMBL5013614 0.80 PARP1 (0.50) EGFRSMN1; SMN2ALDH1A1MAPK1POLB
SCHEMBL14469060 0.79 EGFR (0.57) EGFRSMN1; SMN2ALDH1A1MAPK1ACLY
SCHEMBL10001170 0.79 EGFR (0.47) EGFRSMN1; SMN2ALDH1A1MAPK1POLB
SCHEMBL10031554 0.79 EGFR (0.47) EGFRSMN1; SMN2ALDH1A1MAPK1POLB
SCHEMBL5425587 0.79 EGFR (0.47) EGFRSMN1; SMN2ALDH1A1MAPK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100488962-C Derivative of thiadiazoles containing cyclo oxdiazole, synthetic method, and biological activity UNIV NANKAI (CN) 2009-05-20 CN claimed
US-10626126-B2 Compounds PULMOCIDE LIMITED (GB) 2020-04-21 US disclosed
US-20190256530-A1 BORON-CONTAINING SMALL MOLECULES AS ANTIPROTOZOAL AGENTS ANACOR PHARMACEUTICALS, INC. 2019-08-22 US disclosed
CN-109906224-A TRIAZOLOPYRIDINE COMPOUNDS AND USES THEREOF 诺华股份有限公司 2019-06-18 CN disclosed
US-10301329-B2 Boron-containing small molecules as antiprotozoal agents ANACOR PHARMACEUTICALS, INC. (US) 2019-05-28 US disclosed
US-20190092791-A1 COMPOUNDS PULMOCIDE LIMITED (GB) 2019-03-28 US disclosed
CN-108112251-A NRF2 conditioning agents 葛兰素史克知识产权发展有限公司 2018-06-01 CN disclosed
US-20170355718-A1 Novel 5,6-Dihydro-4H-benzo[b]thieno-[2,3-d]azepine derivatives PULMOCIDE LIMITED (GB) 2017-12-14 US disclosed
US-20170355718-A1 Novel 5,6-Dihydro-4H-benzo[b]thieno-[2,3-d]azepine derivatives PULMOCIDE LIMITED (GB) 2017-12-14 US disclosed
WO-2017175000-A1 COMPOUNDS PULMOCIDE LIMITED (GB) 2017-10-12 WO disclosed
EP-1404668-A1 VARIOLIN DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS PHARMA MAR, S.A. (ES) 2004-04-07 EP disclosed
WO-2003006457-A1 VARIOLIN DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS PHARMA MAR, S.A. (ES) 2003-01-23 WO disclosed
EP-0550900-A1 Herbicidal and plant-nematocidal compositions based on mercaptonicotinic acid derivatives BAYER AG (DE) 1993-07-14 EP disclosed
US-4882342-A CARDIOVASCULAR DISORDERS BOEHRINGER MANNHEIM GMBH (DE) 1989-11-21 US disclosed
US-RE32975-E FUNGICIDES, BACTERICIDES, FEED ADDITIVES BAYER AKTIENGESELLSCHAFT (DE) 1989-07-04 US disclosed
US-4808620-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETIC, ANTIALLERGENS, ANTIARTHRITIC, ANTIRHEUMATIC AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-02-28 US disclosed
EP-0254241-A1 Pyrazolopyridine compounds, their preparation and use Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-27 EP disclosed
EP-0004279-B1 PROCESS FOR THE PREPARATION OF 4-PYRIDONE-3-CARBOXYLIC ACIDS, 1-CYCLOPROPYL-4-PYRIDONE-3-CARBOXYLIC ACID DERIVATIVES AND MEDICINES CONTAINING THEM BAYER AG (DE) 1982-12-29 EP disclosed
US-4284629-A ANIMAL GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1981-08-18 US disclosed
EP-0004279-A1 Process for the preparation of 4-pyridone-3-carboxylic acids, 1-cyclopropyl-4-pyridone-3-carboxylic acid derivatives and medicines containing them BAYER AG (DE) 1979-10-03 EP 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 (5 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-10626126-B2 Compounds QDPR, TXNRD2, TXNRD3 EGFR 4499/4885SMN1; SMN2 239/4885ALDH1A1 932/4885
US-20190092791-A1 COMPOUNDS QDPR, TXNRD2, TXNRD3 EGFR 4499/4885SMN1; SMN2 239/4885ALDH1A1 932/4885
US-10301329-B2 Boron-containing small molecules as antiprotozoal agents BTD, BAD, BRI3BP EGFR 4823/4885SMN1; SMN2 3037/4885ALDH1A1 4684/4885
US-20190256530-A1 BORON-CONTAINING SMALL MOLECULES AS ANTIPROTOZOAL AGENTS BTD, BAD, BRI3BP EGFR 4823/4885SMN1; SMN2 3037/4885ALDH1A1 4684/4885
US-20170355718-A1 Novel 5,6-Dihydro-4H-benzo[b]thieno-[2,3-d]azepine derivatives DDX5, ZC3HAV1, MAVS EGFR 3484/4885SMN1; SMN2 1075/4885ALDH1A1 2557/4885

“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.