SCHEMBL7090488

SCHEMBL7090488

Nc1ccc(C(=O)c2ccc(N)cc2Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.53
TYK2 P29597 1/20 0.53
CYP3A4 P08684 4/20 0.52
TSHR P16473 3/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
RECQL P46063 3/20 0.50
ALDH1A1 P00352 2/20 0.50
CASP1 P29466 2/20 0.50
HSD17B10 Q99714 2/20 0.50
THRB P10828 2/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
CHRM2 P08172 1/20 0.47
CHRM3 P20309 1/20 0.47
MAOA P21397 1/20 0.47
HTR2C P28335 1/20 0.47
CHRNA4 P43681 1/20 0.47
HTR3A P46098 1/20 0.47
KCNH2 Q12809 1/20 0.47

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
SCHEMBL7183309 0.88 SRD5A2 (0.54) JAK2TYK2CYP3A4TSHRCA1
SCHEMBL7035012 0.86 CYP3A4 (0.48) JAK2TYK2CYP3A4TSHRCA1
SCHEMBL1149168 0.85 SRD5A2 (0.60) JAK2TYK2TSHRRECQLCASP1
SCHEMBL5963546 0.85 MAPK13 (0.58) JAK2TYK2ALDH1A1HSD17B10ALOX15
SCHEMBL11630588 0.84 JAK2 (0.51) JAK2TYK2CYP3A4TSHRCA1
SCHEMBL99697 0.84 CASP1 (0.63) JAK2TYK2CYP3A4TSHRCA1
SCHEMBL2335079 0.84 KMT2A (0.55) JAK2TYK2CYP3A4TSHRCA1
SCHEMBL5174662 0.84 RAB9A (0.48) JAK2TYK2CYP3A4TSHRRECQL
SCHEMBL5172393 0.84 MAPK13 (0.61) CYP3A4RECQLALDH1A1RORCRORB
SCHEMBL7194395 0.83 HSD17B10 (0.58) JAK2TYK2CYP3A4TSHRCA1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9353224-B2 Poly(imide-amide) copolymer and composition including poly(imide-amide) copolymer SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-05-31 US disclosed
US-9353224-B2 Poly(imide-amide) copolymer and composition including poly(imide-amide) copolymer SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-05-31 US disclosed
US-20150057426-A1 POLY(IMIDE-AMIDE) COPOLYMER AND COMPOSITION INCLUDING POLY(IMIDE-AMIDE) COPOLYMER SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-02-26 US disclosed
US-20150057426-A1 POLY(IMIDE-AMIDE) COPOLYMER AND COMPOSITION INCLUDING POLY(IMIDE-AMIDE) COPOLYMER SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-02-26 US disclosed
US-20030171422-A1 New nitromethyl ketones, process for preparing them and compositions containing them MERCK PATENT GMBH (DE) 2003-09-11 US disclosed
US-6559185-B2 Nitromethyl ketone compounds having aldose reduction inhibiting properties and methods for their use MERCK PATENT GMBH (DE) 2003-05-06 US disclosed
US-20030069312-A1 Antidiabetic agents LARDY CLAUDE (FR) 2003-04-10 US disclosed
US-20030064235-A1 Optical members made of polymide resins MITSUI CHEMICALS, INC. (JP) 2003-04-03 US disclosed
EP-1237015-A1 OPTICAL MEMBERS MADE OF POLYIMIDE RESINS Mitsui Chemicals, Inc. (JP) 2002-09-04 EP disclosed
US-6043281-A ALDOSE REDUCTASE INHIBITORS; TREATMENT OR PREVENTION OF COMPLICATIONS OF DIABETES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-03-28 US disclosed
EP-0983226-A1 NEW NITROMETHYL KETONES, PROCESS FOR PREPARING THEM AND COMPOSITIONS CONTAINING THEM MERCK PATENT GmbH (DE) 2000-03-08 EP disclosed
US-5932765-A REDUCTASE INHIBITORS MERCK PATENT GESELLSCHAFT MIT (DE) 1999-08-03 US disclosed
WO-1998052906-A1 NEW NITROMETHYL KETONES, PROCESS FOR PREPARING THEM AND COMPOSITIONS CONTAINING THEM MERCK PATENT GMBH (DE) 1998-11-26 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 (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-20030069312-A1 Antidiabetic agents SLC5A1, SLC5A2, GPR119 JAK2 4640/4885TYK2 4845/4885CYP3A4 300/4885
US-20030171422-A1 New nitromethyl ketones, process for preparing them and compositions containing them AKR1B1, AKR1A1, AKR1C1 JAK2 4863/4885TYK2 4504/4885CYP3A4 212/4885

“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.