SCHEMBL11273709

SCHEMBL11273709

Clc1ccc(C2=Nc3cccc4cccc(c34)N2)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 12/20 0.64
GAA P10253 12/20 0.64
MEN1 O00255 11/20 0.64
MAPT P10636 8/20 0.64
LMNA P02545 5/20 0.64
MCL1 Q07820 3/20 0.64
KDM4E B2RXH2 2/20 0.64
USP2 O75604 2/20 0.63
RAB9A P51151 2/20 0.63
ALOX12 P18054 1/20 0.63
ALDH1A1 P00352 3/20 0.60
NPC1 O15118 3/20 0.60
CYP1A2 P05177 2/20 0.59
CYP2D6 P10635 2/20 0.59
ESR1 P03372 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
PKM P14618 1/20 0.51
APAF1 O14727 1/20 0.46
PLCG1 P19174 1/20 0.46
CCR6 P51684 1/20 0.46

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
SCHEMBL10085969 0.85 KMT2A (0.87) KMT2AGAAMEN1MAPTLMNA
SCHEMBL11279534 0.84 KMT2A (0.74) KMT2AGAAMEN1MAPTLMNA
SCHEMBL10086015 0.83 KMT2A (0.84) KMT2AGAAMEN1MAPTLMNA
SCHEMBL10086016 0.82 GAA (0.72) KMT2AGAAMEN1MAPTLMNA
SCHEMBL15018298 0.79 KMT2A (0.77) KMT2AGAAMEN1MAPTLMNA
SCHEMBL3395971 0.79 KMT2A (1.00) KMT2AGAAMEN1MAPTLMNA
SCHEMBL4171644 0.78 GAA (1.00) KMT2AGAAMEN1MAPTLMNA
SCHEMBL10084925 0.78 KMT2A (0.70) KMT2AGAAMEN1MAPTLMNA
SCHEMBL11874703 0.78 KMT2A (0.74) KMT2AGAAMEN1MAPTLMNA
SCHEMBL4159123 0.78 KMT2A (0.74) KMT2AGAAMEN1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0002906-B1 NOVEL PERIMIDINES, THEIR PREPARATION, FORMULATIONS AND USE AS IMMUNOSUPPRESSIVES ELI LILLY AND COMPANY (US) 1982-04-14 EP disclosed
EP-0002906-A2 Novel perimidines, their preparation, formulations and use as immunosuppressives ELI LILLY AND COMPANY (US) 1979-07-11 EP disclosed