SCHEMBL21119802

SCHEMBL21119802

c1ccc2cc3c(-c4nc5ccc6sc7ccccc7c6c5c5ccccc45)ccc(-c4ccc5ccc6cccnc6c5n4)c3cc2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.31
CYP3A4 P08684 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ESR1 P03372 1/20 0.31
POLB P06746 1/20 0.31
AGTR1 P30556 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
GMNN O75496 1/20 0.31
TP53 P04637 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MMP2 P08253 1/20 0.31
CYP2D6 P10635 1/20 0.31
MMP9 P14780 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL21119804 0.96 LMNA (0.37) LMNAKDM4EMAPTCYP3A4MEN1
SCHEMBL21119893 0.93 LMNA (0.36) LMNAKDM4EMAPTCYP3A4MEN1
SCHEMBL21119702 0.90 KDM4E (0.34) KDM4EMAPTALDH1A1
SCHEMBL21119995 0.87 LMNA (0.34) LMNAKDM4EMAPTCYP3A4MEN1
SCHEMBL21119975 0.86 CCR1 (0.34) LMNAKDM4EMAPTCYP3A4MEN1
SCHEMBL21119683 0.86 LMNA (0.37) LMNAKDM4EMAPTCYP3A4MEN1
SCHEMBL21119983 0.85 LMNA (0.36) LMNAKDM4EMAPTCYP3A4MEN1
SCHEMBL21119593 0.85 LMNA (0.36) LMNAKDM4EMAPTCYP3A4MEN1
SCHEMBL21119695 0.85 KDM4E (0.33) KDM4EMAPTALDH1A1
SCHEMBL21119922 0.82 CCR1 (0.36) LMNAKDM4EMAPTCYP3A4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11522139-B2 Organic light emitting diode LG DISPLAY CO., LTD. (KR) 2022-12-06 US disclosed
US-20190207123-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2019-07-04 US disclosed
US-9353111-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed