SCHEMBL20062912

SCHEMBL20062912

Cc1ccc2c(c1)N(c1cc(C)nc(C)c1)C(=C1N(c3cc(C)nc(C)c3)c3cc(C)c(C)cc3N1c1cc(C)nc(C)c1)N2c1cc(C)nc(C)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 4/20 0.32
HSD17B10 Q99714 2/20 0.32
TSHR P16473 2/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CYP1A2 P05177 3/20 0.32
MAPK1 P28482 2/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31
HKDC1 Q2TB90 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MAPT P10636 1/20 0.31
CYP2A6 P11509 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL20681871 0.88 TSHR (0.33) KDM4EALDH1A1TSHRMEN1KMT2A
SCHEMBL18905739 0.78 HSP90AA1 (0.42) LMNAALDH1A1HSD17B10KMT2ANPC1
SCHEMBL20062910 0.78 CYP1A2 (0.35) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL20062868 0.78 HSD17B10 (0.30) LMNAHSD17B10
SCHEMBL20062924 0.77 ALDH1A1 (0.39) LMNAKDM4EALDH1A1HSD17B10MEN1
SCHEMBL20062922 0.77 GAA (0.33) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL18905733 0.76 ELANE (0.46) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL20071972 0.75 ALDH1A1 (0.36) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL20062907 0.75 ALDH1A1 (0.36) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL20062913 0.74 GAA (0.36) LMNAKDM4EALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180108691-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, OPTICAL AREA SENSOR, IMAGING DEVICE, AND IMAGING APPARATUS CANON KABUSHIKI KAISHA (JP) 2018-04-19 US disclosed