SCHEMBL19954813

SCHEMBL19954813

CCNc1ccc2c(c1)C(c1ccc3c(c1)CC3)(c1ccc3c(c1)CC3)c1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 5/20 0.36
KDM4E B2RXH2 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
OPRK1 P41145 1/20 0.36
POLB P06746 2/20 0.34
PDK2 Q15119 3/20 0.34
ALDH1A1 P00352 5/20 0.33
GAA P10253 3/20 0.33
AVPR2 P30518 1/20 0.32
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32
TP53 P04637 1/20 0.32
NFKB1 P19838 1/20 0.32
HTT P42858 1/20 0.32
NFKB2 Q00653 1/20 0.32

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
SCHEMBL7052319 0.79 LMNA (0.52) ESR1ESR2MEN1KMT2AMAPT
SCHEMBL19954721 0.78
SCHEMBL29579600 0.76 LMNA (0.41) ESR1ESR2MEN1KMT2AMAPT
SCHEMBL7050458 0.76 LMNA (0.41) ESR1ESR2MEN1KMT2AMAPT
SCHEMBL30523885 0.75 MEN1 (0.50) ESR1ESR2MEN1KMT2AMAPT
SCHEMBL30523884 0.75 MEN1 (0.50) ESR1ESR2MEN1KMT2AMAPT
SCHEMBL20321512 0.75 PDK2 (0.45) ESR1ESR2MEN1KMT2AMAPT
SCHEMBL17961919 0.75 PDK2 (0.44) ESR1ESR2MEN1KMT2AMAPT
SCHEMBL7048388 0.74 LMNA (0.46) ESR1ESR2MEN1KMT2AMAPT
SCHEMBL29579333 0.74 LMNA (0.46) ESR1ESR2MEN1KMT2AMAPT

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-9917273-B2 Cross-linking polymer and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2018-03-13 US disclosed