SCHEMBL2193750

SCHEMBL2193750

Cc1nc2c(NCc3ccccc3)cccn2c1C

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.60
CYP2C9 P11712 8/20 0.60
CYP2D6 P10635 5/20 0.60
CYP1A2 P05177 4/20 0.60
CYP2C19 P33261 4/20 0.60
ATP4A P20648 5/20 0.49
ATP4B P51164 5/20 0.49
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 1/20 0.45
HSD17B10 Q99714 2/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL10532145 0.86 ATP4A (0.61) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL6351500 0.85 CYP2C9 (0.52) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL2189557 0.82 ATP4A (0.66) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL6352082 0.82 CYP3A4 (0.73) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL6356025 0.81 CYP3A4 (0.59) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL6351492 0.81 CYP3A4 (0.81) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL6360654 0.81 CYP3A4 (0.50) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL6350755 0.80 CYP3A4 (0.67) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL6417257 0.79 CYP3A4 (0.66) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19
SCHEMBL6360355 0.79 CYP3A4 (0.59) CYP3A4CYP2C9CYP2D6CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150086497-A1 Skin Lightening Compositions ELC MAN LLC (US) 2015-03-26 US claimed
EP-0033094-B1 IMIDAZO(1,2-A)PYRIDINES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1984-10-10 EP claimed
EP-0033094-A1 Imidazo(1,2-a)pyridines, processes for their preparation and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1981-08-05 EP claimed
EP-2521531-B1 SKIN LIGHTENING COMPOSITIONS ELC MAN LLC (US) 2017-07-12 EP disclosed
US-20170035672-A1 SKIN LIGHTENING COMPOSITIONS ELC MAN LLC (US) 2017-02-09 US disclosed
EP-3103437-A1 SKIN LIGHTENING COMPOSITIONS ELC Management LLC (US) 2016-12-14 EP disclosed
US-9314415-B2 Skin lightening compositions ELC MANAGEMENT LLC (US) 2016-04-19 US disclosed
US-8992897-B2 Skin lightening compositions ELC MANAGEMENT LLC (US) 2015-03-31 US disclosed
US-20150086497-A1 Skin Lightening Compositions ELC MAN LLC (US) 2015-03-26 US disclosed
US-20140212365-A9 SKIN LIGHTENING COMPOSITIONS NIKI YOKO (JP) 2014-07-31 US disclosed
US-20140154190-A1 Skin Lightening Compositions ELC MANAGEMENT, LLC (US) 2014-06-05 US disclosed
US-20140112877-A1 SKIN LIGHTENING COMPOSITIONS NIKI YOKO (JP) 2014-04-24 US disclosed
EP-2521531-A2 SKIN LIGHTENING COMPOSITIONS ELC Management LLC (US) 2012-11-14 EP disclosed
US-20110171149-A1 Skin Lightening Compositions ELC MANAGEMENT LLC 2011-07-14 US disclosed
WO-2011085015-A2 SKIN LIGHTENING COMPOSITIONS ELC MANAGEMENT LLC (US) 2011-07-14 WO disclosed
EP-0339071-A1 IMIDAZO(1,2-a)(PYRIDAZINES OR PYRAZINES) FOR TREATMENT OF DISEASES RELATED TO BONE LOSS Aktiebolaget Hässle (SE) 1989-11-02 EP disclosed
WO-1989003833-A1 IMIDAZO(1,2-a)(PYRIDAZINES OR PYRAZINES) FOR TREATMENT OF DISEASES RELATED TO BONE LOSS Aktiebolaget Hässle (SE) 1989-05-05 WO disclosed
EP-0033094-B1 IMIDAZO(1,2-A)PYRIDINES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1984-10-10 EP disclosed
US-4450164-A ANTIULCER AND ANTISECRETORY AGENTS SCHERING CORPORATION (US) 1984-05-22 US disclosed
EP-0033094-A1 Imidazo(1,2-a)pyridines, processes for their preparation and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1981-08-05 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 (6 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-20110171149-A1 Skin Lightening Compositions CUTA, TYR, DSG1 CYP3A4 2827/4885CYP2C9 2552/4885CYP2D6 2870/4885
US-20140212365-A9 SKIN LIGHTENING COMPOSITIONS CUTA, TYR, DSG1 CYP3A4 2827/4885CYP2C9 2552/4885CYP2D6 2870/4885
US-20170035672-A1 SKIN LIGHTENING COMPOSITIONS CUTA, TYR, DSG1 CYP3A4 2827/4885CYP2C9 2552/4885CYP2D6 2870/4885
US-20140154190-A1 Skin Lightening Compositions TYR, MC1R, AHR CYP3A4 274/4885CYP2C9 315/4885CYP2D6 169/4885
US-20140112877-A1 SKIN LIGHTENING COMPOSITIONS CUTA, TYR, DSG1 CYP3A4 2827/4885CYP2C9 2552/4885CYP2D6 2870/4885
US-20150086497-A1 Skin Lightening Compositions CUTA, TYR, DSG1 CYP3A4 2827/4885CYP2C9 2552/4885CYP2D6 2870/4885

“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.