SCHEMBL182518

SCHEMBL182518

CCCCCCCCn1cc2c(c1)OCCCO2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.40
RAB9A P51151 7/20 0.40
HTT P42858 6/20 0.40
LMNA P02545 3/20 0.40
MAPK1 P28482 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
GALR3 O60755 2/20 0.40
POLB P06746 2/20 0.40
ATM Q13315 2/20 0.40
APOBEC3A P31941 2/20 0.40
APOBEC3G Q9HC16 2/20 0.40
HSP90AA1 P07900 2/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
RAD52 P43351 1/20 0.40
PAX8 Q06710 1/20 0.40
NR2F2 P24468 1/20 0.40
NOD2 Q9HC29 1/20 0.40
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL17626547 0.93 NPC1 (0.42) NPC1RAB9AHTTLMNAMAPK1
SCHEMBL17646207 0.93 NPC1 (0.42) NPC1RAB9AHTTLMNAMAPK1
SCHEMBL17646200 0.93 NPC1 (0.42) NPC1RAB9AHTTLMNAMAPK1
SCHEMBL3249818 0.76 EBP (0.39) NPC1RAB9AHTTLMNAMAPK1
SCHEMBL182517 0.73 NPC1 (0.36) NPC1RAB9AHTTLMNAMAPK1
SCHEMBL3250243 0.73 SMN1; SMN2 (0.31) SMN1; SMN2ALDH1A1
SCHEMBL14046558 0.72 CHRM2 (0.40) MAPK1MAPTKDM4EALDH1A1CYP2D6
SCHEMBL182476 0.71 KDM4E (0.32) HTTMAPTKDM4EALDH1A1
SCHEMBL182198 0.71 ITGB2 (0.33) NPC1RAB9ASMN1; SMN2ALDH1A1CYP2C19
SCHEMBL9302590 0.70 NPC1 (0.48) NPC1RAB9AHTTLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1465962-B1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIV FLORIDA (US) 2012-01-04 EP disclosed
EP-1465962-A1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIVERSITY OF FLORIDA (US) 2004-10-13 EP disclosed
US-6791738-B2 CONTROLLING COLOR, BRIGHTNESS AND ENVIRONMENTAL STABILITY; POLY- 3,4-ALKYLENEDIOXYHETEROCYCLES UNIVERSITY OF FLORIDA 2004-09-14 US disclosed
US-20030174377-A1 Electrochromic polymers and polymer electrochromic devices UNIVERSITY OF FLORIDA 2003-09-18 US disclosed
WO-2003046106-A1 ELECTROCHROMIC POLYMERS AND POLYMER ELECTROCHROMIC DEVICES UNIVERSITY OF FLORIDA (US) 2003-06-05 WO disclosed