SCHEMBL14026401

SCHEMBL14026401

CCc1ccc2c(c1)c1cc(C(C)C)ccc1n2-c1ccc(-n2c(-c3ccccc3)nnc2-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
UCHL3 P15374 2/20 0.46
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
AVPR1A P37288 1/20 0.37
GLA P06280 1/20 0.37
RORA P35398 1/20 0.37
RORC P51449 1/20 0.37
RORB Q92753 1/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
PTGES2 Q9H7Z7 1/20 0.35
OXTR P30559 1/20 0.35
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
HSD11B1 P28845 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 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
SCHEMBL10111087 0.91 HPGD (0.48) HPGDSMN1; SMN2AVPR1AGLARORA
SCHEMBL10111088 0.91 AVPR1A (0.44) UCHL3HPGDSMN1; SMN2AVPR1AGLA
SCHEMBL10110918 0.88 AVPR1A (0.49) UCHL3HPGDSMN1; SMN2AVPR1AGLA
SCHEMBL10110922 0.88 SMN1; SMN2 (0.52) HPGDSMN1; SMN2AVPR1AGLAALDH1A1
SCHEMBL10111090 0.83 HPGD (0.44) UCHL3HPGDSMN1; SMN2AVPR1AGLA
SCHEMBL10126581 0.82 SMN1; SMN2 (0.42) UCHL3HPGDSMN1; SMN2AVPR1AGLA
SCHEMBL10110927 0.81 HPGD (0.48) UCHL3HPGDSMN1; SMN2AVPR1AGLA
SCHEMBL14026360 0.81 AVPR1A (0.42) UCHL3HPGDSMN1; SMN2AVPR1AGLA
SCHEMBL10111086 0.81 SMN1; SMN2 (0.46) UCHL3HPGDSMN1; SMN2AVPR1AGLA
SCHEMBL10110929 0.80 SMN1; SMN2 (0.46) UCHL3HPGDSMN1; SMN2AVPR1AGLA

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
WO-2008143019-A1 TRIAZOLE DERIVATIVE, AND LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC DEVICE WITH THE USE OF TRIAZOLE DERIVATIVE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-11-27 WO disclosed