SCHEMBL182517

SCHEMBL182517

CCCCCCCCn1cc2c(c1)OOCCC2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.36
RAB9A P51151 9/20 0.36
HTT P42858 8/20 0.36
LMNA P02545 5/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
NPSR1 Q6W5P4 4/20 0.36
GALR3 O60755 3/20 0.36
POLB P06746 3/20 0.36
ATM Q13315 2/20 0.36
MAPK1 P28482 2/20 0.36
APOBEC3A P31941 2/20 0.36
APOBEC3G Q9HC16 2/20 0.36
MAPT P10636 2/20 0.36
NR2F2 P24468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HSP90AA1 P07900 1/20 0.36
RAD52 P43351 1/20 0.36
PAX8 Q06710 1/20 0.36
NOD2 Q9HC29 1/20 0.36
ALDH1A1 P00352 3/20 0.34

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
SCHEMBL182878 0.88 MEN1 (0.30) ALDH1A1MEN1KMT2A
SCHEMBL182475 0.77
SCHEMBL182197 0.74
SCHEMBL182518 0.73 NPC1 (0.40) NPC1RAB9AHTTLMNASMN1; SMN2
SCHEMBL17646200 0.73 NPC1 (0.42) NPC1RAB9AHTTLMNASMN1; SMN2
SCHEMBL17646207 0.73 NPC1 (0.42) NPC1RAB9AHTTLMNASMN1; SMN2
SCHEMBL17626547 0.73 NPC1 (0.42) NPC1RAB9AHTTLMNASMN1; SMN2
SCHEMBL3249816 0.71 SIGMAR1 (0.37) NPC1RAB9AHTTLMNASMN1; SMN2
SCHEMBL7154930 0.65 SLC6A2 (0.40) LMNAKDM4EALDH1A1TBXAS1ALOX5
SCHEMBL7160512 0.65 SLC6A2 (0.40) LMNAKDM4EALDH1A1TBXAS1ALOX5

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