SCHEMBL10103384

SCHEMBL10103384

COCCCCN1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.56
ALDH1A1 P00352 4/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.49
ATM Q13315 1/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL13849154 0.98 HRH3 (0.61) HRH3ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL10103385 0.98 HRH3 (0.61) HRH3ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL21472087 0.96 HRH3 (0.65) HRH3ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL1277016 0.93 HRH3 (0.52) HRH3ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL2331849 0.91 HRH3 (0.56) HRH3ALDH1A1CYP2D6L3MBTL1MAPT
SCHEMBL96486 0.91 HRH3 (0.56) HRH3ALDH1A1CYP2D6L3MBTL1MAPT
SCHEMBL11574905 0.90
SCHEMBL11570576 0.88 HRH3 (0.46) HRH3ALDH1A1
SCHEMBL10927336 0.88 HRH3 (0.46) HRH3ALDH1A1
SCHEMBL11569007 0.88 HRH3 (0.46) HRH3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3854402-A1 TREATMENT OR PREVENTION OF TRANSPLANT REJECTION CTI Biopharma Corp. (US) 2021-07-28 EP disclosed
EP-3181554-B1 QUINAZOLINE DERIVATIVE CSPC ZHONGQI PHARMACEUTICAL TECH SHIJIAZHUANG CO LTD (CN) 2020-10-28 EP disclosed
US-20170226099-A1 QUINAZOLINE DERIVATIVE CSPC ZHONGQI PHARMACEUTICAL TECHNOLOGY (SHIJIAZHUANG) CO., LTD. (CN) 2017-08-10 US disclosed
US-20160199297-A1 BIODEGRADABLE INTRAVITREAL TYROSINE KINASE IMPLANTS ALLERGAN, INC. 2016-07-14 US disclosed
WO-2016023330-A1 QUINAZOLINE DERIVATIVE 石药集团中奇制药技术(石家庄)有限公司 2016-02-18 WO disclosed
US-9233070-B2 Biodegradable intravitreal tyrosine kinase implants ALLERGAN, INC. (US) 2016-01-12 US disclosed
US-9056045-B2 Intraocular biodegradable microspheres ALLERGAN, INC. (US) 2015-06-16 US disclosed
US-8968766-B2 Sustained release intraocular implants containing tyrosine kinase inhibitors and related methods ALLERGAN, INC. (US) 2015-03-03 US disclosed
US-8835643-B2 Molecules, compositions, and methods for light absorption EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2014-09-16 US disclosed
US-20140193348-A1 MOLECULES, COMPOSITIONS, AND METHODS FOR LIGHT ABSORPTION CRESTLINE DIRECT FINANCE, L.P. 2014-07-10 US disclosed
EP-2142189-B1 METHODS AND COMPOSITIONS FOR INTRAOCULAR ADMINISTRATION TO TREAT OCULAR CONDITIONS ALLERGAN INC (US) 2013-02-27 EP disclosed
US-20120165333-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-28 US disclosed
US-20110268698-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2011-11-03 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-7771742-B2 Producing eye insertable drug delivery agent; extruding active ingredient with polyvinyl alcohol free biodegradable polymer; pharmacokinetics ALLERGAN, INC. (US) 2010-08-10 US disclosed
EP-1519915-B1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS LILLY CO ELI (US) 2009-05-27 EP disclosed
US-20080260803-A1 Producing eye insertable drug delivery agent; extruding active ingredient with polyvinyl alcohol free biodegradable polymer ALLERGAN,INC. (US) 2008-10-23 US disclosed
US-20080254096-A1 Using polyvinyl alcohol free biodegradable polymer matrix; reducing side effects, invasive procedures and high transient concentrations; glaucoma, proliferative vitreoretinopathy ALLERGAN,INC (US) 2008-10-16 US disclosed
WO-2008121665-A1 METHODS AND COMPOSITIONS FOR INTRAOCULAR ADMINISTRATION TO TREAT OCULAR CONDITIONS ALLERGAN, INC. (US) 2008-10-09 WO disclosed
US-20080241252-A1 METHODS AND COMPOSITIONS FOR INTRAOCULAR ADMINISTRATION TO TREAT OCULAR CONDITIONS ALLERGAN, INC. (US) 2008-10-02 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 (8 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-20110268698-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, LIPC, HCCS HRH3 1844/4885ALDH1A1 563/4885MEN1 4825/4885
US-20120165333-A1 C-MET PROTEIN KINASE INHIBITORS MET, PRKCH, ABL1 HRH3 3184/4885ALDH1A1 1951/4885MEN1 319/4885
US-20140193348-A1 MOLECULES, COMPOSITIONS, AND METHODS FOR LIGHT ABSORPTION CRY1, ERCC1, CRY2 HRH3 4509/4885ALDH1A1 77/4885MEN1 966/4885
US-20170226099-A1 QUINAZOLINE DERIVATIVE H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TOP2A, TOP1 HRH3 1955/4885ALDH1A1 2644/4885MEN1 2146/4885
US-20160199297-A1 BIODEGRADABLE INTRAVITREAL TYROSINE KINASE IMPLANTS KDR, PTK2B, DSTYK HRH3 2521/4885ALDH1A1 1537/4885MEN1 3082/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS HRH3 3336/4885ALDH1A1 1497/4885MEN1 4800/4885
US-20080254096-A1 Using polyvinyl alcohol free biodegradable polymer matrix; reducing side effects, invasive procedures and high transient concentrations; glaucoma, proliferative vitreoretinopathy VEGFA, PTK2, KDR HRH3 3764/4885ALDH1A1 1521/4885MEN1 1851/4885
US-20080241252-A1 METHODS AND COMPOSITIONS FOR INTRAOCULAR ADMINISTRATION TO TREAT OCULAR CONDITIONS FLT1, JAK1, KDR HRH3 4038/4885ALDH1A1 4379/4885MEN1 4086/4885

“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.