SCHEMBL18463296

SCHEMBL18463296

CC1(C)c2ccccc2-c2c(-c3nc(-c4ccccc4)nc(-c4ccc5cc6ccccc6cc5c4)n3)cccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
CYP1A2 P05177 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
ADORA2A P29274 2/20 0.33
ADORA1 P30542 2/20 0.33
ALOX15 P16050 2/20 0.33
ADORA3 P0DMS8 1/20 0.33
TSHR P16473 1/20 0.33
ADORA2B P29275 1/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
PDK2 Q15119 2/20 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
SCHEMBL24122798 0.93 MEN1 (0.39) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL18463294 0.92 HDAC4 (0.37) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL19271436 0.89 LPL (0.35) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL18386120 0.89 L3MBTL1 (0.35) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL26278668 0.89 ALDH1A1 (0.36) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL22309619 0.89 CYP1A1 (0.40) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL22038445 0.88 L3MBTL1 (0.37) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL26937498 0.88 L3MBTL1 (0.37) MEN1KMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL18386128 0.88 HDAC4 (0.39) KDM4ECYP1A2ADORA2AADORA1PDK2
SCHEMBL24472994 0.88 ALDH1A1 (0.35) MEN1KMT2AALDH1A1KDM4ECYP1A2

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-20180222872-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-08-09 US disclosed
US-20180222872-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-08-09 US disclosed
WO-2017016630-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-02-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180222872-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES PIEZO1, NES, PIR MEN1 1449/4885KMT2A 2402/4885ALDH1A1 399/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.