SCHEMBL113168

SCHEMBL113168

OCc1cnc(Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.42
PDXK O00764 1/20 0.39
ALDH1A1 P00352 4/20 0.37
NPSR1 Q6W5P4 3/20 0.37
MRGPRX4 Q96LA9 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
S1PR4 O95977 1/20 0.34
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL1549300 0.83 ALDH1A1 (0.36) RECQLPDXKALDH1A1NPSR1TDP1
SCHEMBL20876899 0.80 PDXK (0.42) RECQLPDXKALDH1A1NPC1RAB9A
SCHEMBL30513481 0.80 PDXK (0.42) RECQLPDXKALDH1A1NPC1RAB9A
SCHEMBL1141323 0.79 ALDH1A1 (0.42) ALDH1A1NPSR1TDP1
SCHEMBL30833526 0.79 ALDH1A1 (0.42) ALDH1A1NPSR1TDP1
SCHEMBL335739 0.78 RECQL (0.39) RECQLPDXKNPC1RAB9APOLB
SCHEMBL22990491 0.78 RECQL (0.39) RECQLPDXKNPC1RAB9APOLB
SCHEMBL9649790 0.78 CPB2 (0.50) RECQLNPC1RAB9APOLB
SCHEMBL335231 0.78 RECQL (0.39) RECQLPDXKNPC1RAB9APOLB
SCHEMBL487778 0.78 CYP11B1 (0.50) RECQLPDXKALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105884679-A Method for preparing 5, 6-dichloro-3-hydroxymethylpyridine-2-phenol from DCTF rectification and short-steaming residues 江苏天宇检测技术有限公司 2016-08-24 CN claimed
US-11912695-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2024-02-27 US disclosed
US-11912695-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2024-02-27 US disclosed
CN-111148735-B Nitrogen-containing heteroaryl compounds and pharmaceutical uses thereof 日本烟草产业株式会社 2023-08-08 CN disclosed
US-20230225323-A1 COMPOSITIONS AND METHODS FOR PARASITE CONTROL PHILIP MORRIS PRODUCTS S.A. (CH) 2023-07-20 US disclosed
US-20230225323-A1 COMPOSITIONS AND METHODS FOR PARASITE CONTROL PHILIP MORRIS PRODUCTS S.A. (CH) 2023-07-20 US disclosed
EP-4172156-A1 COMPOSITIONS AND METHODS FOR PARASITE CONTROL Philip Morris Products S.A. (CH) 2023-05-03 EP disclosed
EP-3693358-B1 NITROGEN-CONTAINING HETEROARYL COMPOUND, AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (JP) 2023-02-22 EP disclosed
CN-115698002-A Compositions and methods for parasite control 菲利普莫里斯生产公司 2023-02-03 CN disclosed
CN-114591226-A Preparation method of nicotinaldehyde derivative 南京益恩生物科技有限公司 2022-06-07 CN disclosed
US-6169183-B1 REACTING 2,3-DIHALOPYRIDINE WITH CARBON MONOXIDE AND ALKANOL IN PRESENCE OF WEAK BASE AND COMPLEX OF PALLADIUM WITH SPECIFIED BIS(DIPHENYLPHOSPHINE), WHEREIN REACTION IS STOPPED AS SOON AS MAXIMUM CONCENTRATION OF ESTER IS ACHIEVED LONZA, LTD. (CH) 2001-01-02 US disclosed
US-6162921-A Process for preparing pyridinecarboxylic esters LONZA, LTD (CH) 2000-12-19 US disclosed
WO-2000046196-A1 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 ANTAGONISTS ASTRAZENECA AB (SE) 2000-08-10 WO disclosed
US-6022973-A Process for preparing pyridinecarboxylic esters LONZA LTD. (CH) 2000-02-08 US disclosed
US-5925765-A Process for preparing pyridinecarboxylic esters LONZA AG (CH) 1999-07-20 US disclosed
EP-0820987-A1 Process for the preparation of pyridine-2,3-dicarboxylic acid esters LONZA AG (CH) 1998-01-28 EP disclosed
EP-0820986-A1 Process for the preparation of pyridine carboxylic acid esters LONZA AG (CH) 1998-01-28 EP disclosed
US-4410530-A CARDIO-SELECTIVE B-RECEPTOR BLOCKING AGENTS AND STIMULANTS CIBA-GEIGY CORPORATION (US) 1983-10-18 US disclosed
US-4195090-A ADRENERGIC BLOCKING AGENTS CIBA-GEIGY CORPORATION (US) 1980-03-25 US disclosed
US-4115575-A CARDIOVASCULAR DISORDERS CIBA-GEIGY CORPORATION (US) 1978-09-19 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 (2 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-20230225323-A1 COMPOSITIONS AND METHODS FOR PARASITE CONTROL TRHDE, CUTA, PIGS RECQL 3071/4885PDXK 4354/4885ALDH1A1 2870/4885
US-11912695-B2 Benzodiazepine derivatives as RSV inhibitors GABRA5, GABRA1, GABBR2 RECQL 3447/4885PDXK 2726/4885ALDH1A1 621/4885

“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.