SCHEMBL10424045

SCHEMBL10424045

Cn1c2nc3ccc(cc31)-c1ccc3nc(n(C)c3c1)-c1ccc-2cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
RAB9A P51151 4/20 0.58
KDM4E B2RXH2 4/20 0.58
PKM P14618 3/20 0.58
NPC1 O15118 3/20 0.58
HSD17B10 Q99714 3/20 0.58
TP53 P04637 2/20 0.58
GAA P10253 1/20 0.58
ALOX15 P16050 1/20 0.58
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
MAPT P10636 4/20 0.54
HPGD P15428 2/20 0.54
HTT P42858 2/20 0.54
GFER P55789 2/20 0.54
LMNA P02545 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CYP11B1 P15538 1/20 0.51
CYP11B2 P19099 1/20 0.51
PDE10A Q9Y233 1/20 0.51

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
SCHEMBL1104827 0.91 PDE10A (0.59) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL10424580 0.91 ALDH1A1 (0.54) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL10423590 0.87 MEN1 (0.57) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL20982482 0.87 ALDH1A1 (0.50) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL20982581 0.87 KDM4E (0.68) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL11435533 0.85 KDM4E (0.71) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL26603188 0.85 ALDH1A1 (0.49) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL20982632 0.85 KDM4E (0.69) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL14000543 0.84 ESRRA (0.48) ALDH1A1RAB9AKDM4EPKMNPC1
SCHEMBL14273647 0.82 NPC1 (0.50) ALDH1A1RAB9AKDM4EPKMNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0145337-B1 ELECTROCHROMIC DEVICES CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1990-08-08 EP claimed
EP-0096723-B1 BATTERIES FABRICATED WITH ELECTROACTIVE POLYMERS CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1988-08-10 EP claimed
US-4613211-A REVERSE COLOR CHANGING POLYMER FILM AS DISPLAY ELECTRODE CHEVRON RESEARCH COMPANY (US) 1986-09-23 US claimed
EP-0145337-A2 Electrochromic devices CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1985-06-19 EP claimed
US-4505840-A Heterocyclic electroactive polymers CHEVRON RESEARCH COMPANY (US) 1985-03-19 US claimed
EP-0096723-A1 BATTERIES FABRICATED WITH ELECTROACTIVE POLYMERS. CHEVRON RES (US) 1983-12-28 EP claimed
WO-1983002368-A1 BATTERIES FABRICATED WITH ELECTROACTIVE POLYMERS CHEVRON RES (US) 1983-07-07 WO claimed
EP-0145337-B1 ELECTROCHROMIC DEVICES CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1990-08-08 EP disclosed
US-4613211-A REVERSE COLOR CHANGING POLYMER FILM AS DISPLAY ELECTRODE CHEVRON RESEARCH COMPANY (US) 1986-09-23 US disclosed
EP-0145337-A2 Electrochromic devices CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1985-06-19 EP disclosed
US-4505840-A Heterocyclic electroactive polymers CHEVRON RESEARCH COMPANY (US) 1985-03-19 US disclosed