SCHEMBL11352201

SCHEMBL11352201

CCCCCCCCCc1c(O)ccc(CN(C)C)c1CN(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.53
KDM4E B2RXH2 5/20 0.47
ALDH1A1 P00352 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 3/20 0.47
HSD17B10 Q99714 3/20 0.47
GLA P06280 2/20 0.47
HPGD P15428 2/20 0.47
CASP1 P29466 2/20 0.47
CASP7 P55210 2/20 0.47
MAPT P10636 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
TP53 P04637 2/20 0.46
CYP3A4 P08684 2/20 0.46
ALOX5 P09917 2/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
POLB P06746 1/20 0.44

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
SCHEMBL11702069 0.90 TYR (0.53) TYRKDM4EALDH1A1MEN1KMT2A
SCHEMBL29521643 0.86 BID (0.50) TYRKDM4EMEN1KMT2AHSD17B10
SCHEMBL29349627 0.82 ALDH1A1 (0.58) KDM4EALDH1A1MEN1KMT2AGAA
SCHEMBL33427 0.82 ALDH1A1 (0.58) KDM4EALDH1A1MEN1KMT2AGAA
SCHEMBL27799002 0.82 ALDH1A1 (0.58) KDM4EALDH1A1MEN1KMT2AGAA
SCHEMBL5143093 0.82 TYR (0.60) TYRKDM4EALDH1A1MEN1KMT2A
SCHEMBL6271499 0.82 TYR (0.60) TYRKDM4EALDH1A1MEN1KMT2A
SCHEMBL3441358 0.82 TYR (0.60) TYRKDM4EALDH1A1MEN1KMT2A
SCHEMBL8936594 0.82 TYR (0.60) TYRKDM4EALDH1A1MEN1KMT2A
SCHEMBL10337301 0.82 TYR (0.60) TYRKDM4EALDH1A1MEN1KMT2A

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
EP-0003479-B1 HARDENING AGENTS AND PROCESS FOR PREPARING EPOXY RESIN POLYADDUCTS SCHERING AKTIENGESELLSCHAFT (DE) 1981-09-16 EP disclosed
US-4269742-A REACTING AN EPOXY COMPOUND WITH A LIQUID AMINE PREPARED BY REACTING A MANNICH BASE WITH A AMINO-AMIDE WITH OR WITHOUT AN IMIDAZOLINE RING, OR A POLYAMINE; LOW TEMPERATURE SCHERING AKTIENGESELLSCHAFT (DE) 1981-05-26 US disclosed
EP-0003479-A1 Hardening agents and process for preparing epoxy resin polyadducts SCHERING AKTIENGESELLSCHAFT (DE) 1979-08-22 EP disclosed