SCHEMBL21849628

SCHEMBL21849628

CC(C)(CCC(C)(C)c1cncc(-n2cccn2)c1)c1ccc(-n2cccn2)nc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ GRN P28799 1/20 0.40
▸ SORT1 Q99523 1/20 0.40
▸ KDM4E B2RXH2 6/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ BRS3 P32247 2/20 0.38
▸ AOC3 Q16853 2/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ CXCR4 P61073 1/20 0.35
▸ NLRP3 Q96P20 1/20 0.35
▸ HPGD P15428 2/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL21851483 0.82 LMNA (0.46) LMNAKMT2AGRNSORT1KDM4E
SCHEMBL21849206 0.76 KDM4E (0.44) LMNAKMT2AKDM4EALDH1A1BRS3
SCHEMBL13990481 0.76 LMNA (0.53) LMNAKMT2AGRNSORT1KDM4E
SCHEMBL21645117 0.70 KDM4E (0.44) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL19954279 0.70 LMNA (0.53) LMNAKMT2AKDM4EALDH1A1RXFP1
SCHEMBL29696309 0.70 LMNA (0.53) LMNAKMT2AKDM4EALDH1A1RXFP1
SCHEMBL23478708 0.69 KIF11 (0.46) —
SCHEMBL19592843 0.68 NOTUM (0.49) KMT2AKDM4EALDH1A1BRS3NLRP3
SCHEMBL46317 0.65 KDM4E (0.58) LMNAKMT2AGRNSORT1KDM4E
SCHEMBL31516755 0.65 KDM4E (0.58) LMNAKMT2AGRNSORT1KDM4E

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-20200102311-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 — — US 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-20200102311-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP LMNA 1845/4885KMT2A 2234/4885GRN 2285/4885

“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.

Send feedback