SCHEMBL15214218

SCHEMBL15214218

O=C(Nn1ccnc1)c1cc(Br)ccc1Cl

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.46
HPGD P15428 1/20 0.45
POLB P06746 3/20 0.44
CYP1A2 P05177 1/20 0.44
GAA P10253 2/20 0.44
LMNA P02545 1/20 0.44
KDM4E B2RXH2 2/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RECQL P46063 1/20 0.41

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
SCHEMBL3470125 0.83 KMT2A (0.63) KMT2AMAPTMEN1HPGDPOLB
SCHEMBL15214217 0.78 MEN1 (0.47) KMT2AMAPTMEN1HPGDPOLB
SCHEMBL3819641 0.70 HPGD (0.60) KMT2AMAPTMEN1HPGDPOLB
SCHEMBL9778626 0.70 ALDH1A1 (0.68) KMT2AMAPTMEN1HPGDPOLB
SCHEMBL6598806 0.67 TSHR (0.53) KMT2AMAPTMEN1LMNATSHR
SCHEMBL28051805 0.67 P2RX7 (0.54) TSHR
SCHEMBL11777386 0.67 MAPT (0.46) KMT2AMAPTMEN1CYP1A2ALDH1A1
SCHEMBL9556295 0.67 POLB (0.52) KMT2AMAPTMEN1HPGDPOLB
SCHEMBL7223858 0.66 HPGD (0.68) KMT2AMAPTMEN1HPGDPOLB
SCHEMBL29092068 0.66 HPGD (0.66) KMT2AMAPTMEN1HPGDPOLB

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-8518940-B2 FP-pocket-binding effectors and methods for using the same to modulate telomerase activity THE WISTAR INSTITUTE (US) 2013-08-27 US disclosed