SCHEMBL16134262

SCHEMBL16134262

CC1(C)c2ccccc2-c2c1cc1ccc3c4c(cc5ccc2c1c53)C(C)(C)c1cc2ccccc2nc1-4

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MBNL1 Q9NR56 1/20 0.38
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
MAPT P10636 5/20 0.35
ALDH1A1 P00352 5/20 0.35
SMN1; SMN2 Q16637 5/20 0.35
KDM4E B2RXH2 4/20 0.35
MEN1 O00255 3/20 0.35
TP53 P04637 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
HSD17B10 Q99714 2/20 0.35
TSHR P16473 2/20 0.34
PKM P14618 1/20 0.34
MAPK1 P28482 1/20 0.34
GLA P06280 2/20 0.33
PDE10A Q9Y233 1/20 0.33

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
SCHEMBL20047276 0.85 CYP1A2 (0.38) KMT2AALDH1A1TP53CYP3A4HSD17B10
SCHEMBL16134261 0.82 PDK2 (0.30)
SCHEMBL16134265 0.81 PDK2 (0.36) KMT2ACYP2C19CYP1A2
SCHEMBL29453032 0.79 KMT2A (0.60) KMT2AMBNL1RAB9ANPC1MAPT
SCHEMBL21226340 0.79 KMT2A (0.60) KMT2AMBNL1RAB9ANPC1MAPT
SCHEMBL12731566 0.78 CYP1A2 (0.34) ACHEERBB2CYP1A2FYNMAOA
SCHEMBL24349368 0.78 KMT2A (0.51) KMT2AMBNL1RAB9ANPC1MAPT
SCHEMBL24349510 0.77 KMT2A (0.42) KMT2AMBNL1RAB9ANPC1MAPT
SCHEMBL12594674 0.76 ERBB2 (0.35) KMT2AALDH1A1CYP3A4HSD17B10TSHR
SCHEMBL12731533 0.76 MLNR (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9825237-B2 Organic electroluminescent element, compound for organic electroluminescent element, and light-emitting device, display device, and illumination device using said element UDC IRELAND LIMITED (IE) 2017-11-21 US disclosed
US-9825237-B2 Organic electroluminescent element, compound for organic electroluminescent element, and light-emitting device, display device, and illumination device using said element UDC IRELAND LIMITED (IE) 2017-11-21 US disclosed
US-20140291652-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND LIGHT-EMITTING DEVICE, DISPLAY DEVICE, AND ILLUMINATION DEVICE USING SAID ELEMENT UDC IRELAND LIMITED (IE) 2014-10-02 US disclosed
US-20140291652-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND LIGHT-EMITTING DEVICE, DISPLAY DEVICE, AND ILLUMINATION DEVICE USING SAID ELEMENT UDC IRELAND LIMITED (IE) 2014-10-02 US disclosed