SCHEMBL1625968

SCHEMBL1625968

Clc1nc2ccc(Cl)c(Cl)c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 3/20 0.33
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33
CYP2A6 P11509 1/20 0.31
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL3421751 0.79 ALDH1A1 (0.47) HCAR1CSNK2A1
SCHEMBL24878849 0.79 HTR2A (0.31)
SCHEMBL7045265 0.79 HTR3E (0.47) HCAR1
SCHEMBL659974 0.79 MAPT (0.40) HCAR1CSNK2A2CSNK2BCSNK2A1
SCHEMBL11762285 0.75 NPC1 (0.34) HCAR1
SCHEMBL7044222 0.75 HCAR1 (0.33) HCAR1
SCHEMBL5738369 0.75 CACNA1H (0.36) HCAR1
SCHEMBL7045388 0.75 NPSR1 (0.44) CSNK2A2CSNK2BCSNK2A1
SCHEMBL66296 0.74 NOS1 (0.44) CYP2A6
SCHEMBL7043132 0.74 GRIN2D (0.39) CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114903848-A Transdermal preparation 阿根塔创新有限公司 2022-08-16 CN disclosed
CN-109549927-B Solid solution compositions and their use in cardiovascular disease 因佛斯特医疗有限公司 2022-03-29 CN disclosed
CN-113038937-A Palatable antiparasitic formulations 硕腾服务有限责任公司 2021-06-25 CN disclosed
CN-111295376-A Injectable isoxazoline pharmaceutical compositions and their use against parasite infestations 英特维特国际股份有限公司 2020-06-16 CN disclosed
US-20120270827-A1 Indole Antiviral Compositions And Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-10-25 US disclosed
US-8202844-B2 Indole antiviral compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-06-19 US disclosed
US-20110178038-A1 Indole Antiviral Compositions And Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-07-21 US disclosed
US-7928080-B2 Indole antiviral compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-04-19 US disclosed
US-7625871-B2 Indole antiviral compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-12-01 US disclosed
US-20090281052-A1 Indole Antiviral Compositions And Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-11-12 US disclosed
US-7419963-B2 Indole antiviral compositions and methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-09-02 US disclosed
US-20080146517-A1 Indole Antiviral Compositions And Methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-06-19 US disclosed
EP-1677784-A1 INDOLE ANTIVIRAL COMPOSITIONS AND METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2006-07-12 EP disclosed
EP-1671972-A1 Octahydropyrrolo[3,4-c]pyrrole derivatives Pfizer Limited (GB) 2006-06-21 EP disclosed
US-20050143329-A1 Indole antiviral compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2005-06-30 US disclosed
WO-2005034943-A1 INDOLE ANTIVIRAL COMPOSITIONS AND METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2005-04-21 WO disclosed
WO-2004047769-A2 BENZIMIDAZOLES AND ANALOGS THEREOF AS ANTIBACTERIALS ISIS PHARMACEUTICALS, INC. (US) 2004-06-10 WO disclosed
WO-1994008456-A1 POLYSUBSTITUTED BENZIMIDAZOLES AS ANTIVIRAL AGENTS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1994-04-28 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 (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-20090281052-A1 Indole Antiviral Compositions And Methods IDO1, IDO2, MAVS HCAR1 1708/4885CSNK2A2 855/4885CSNK2B 829/4885
US-20120270827-A1 Indole Antiviral Compositions And Methods IDO1, IDO2, MAVS HCAR1 1708/4885CSNK2A2 855/4885CSNK2B 829/4885
US-20080146517-A1 Indole Antiviral Compositions And Methods IDO1, IDO2, MAVS HCAR1 1708/4885CSNK2A2 855/4885CSNK2B 829/4885
US-20050143329-A1 Indole antiviral compositions and methods IDO1, IDO2, MAVS HCAR1 1708/4885CSNK2A2 855/4885CSNK2B 829/4885
US-20110178038-A1 Indole Antiviral Compositions And Methods IDO1, IDO2, MAVS HCAR1 1708/4885CSNK2A2 855/4885CSNK2B 829/4885

“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.