SCHEMBL31647306

SCHEMBL31647306

Cn1nc(C(=O)O)c2cc(Br)cc(F)c21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ KMT2A Q03164 2/20 0.33
▸ NMT1 P30419 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ EGLN1 Q9GZT9 1/20 0.32
▸ MAP2K1 Q02750 1/20 0.32
▸ MAPK8 P45983 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ GRN P28799 1/20 0.31
▸ SORT1 Q99523 1/20 0.31
▸ PTGER1 P34995 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ AKR1B1 P15121 2/20 0.30

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
SCHEMBL31647289 0.82 NMT1 (0.37) KMT2ANMT1MCL1MAPK8KDM4E
SCHEMBL20356427 0.82 L3MBTL1 (0.30) L3MBTL1
SCHEMBL13106248 0.77 ADORA2A (0.42) L3MBTL1NMT1LMNAMAPK8KDM4E
SCHEMBL20520461 0.76 PDK1 (0.36) L3MBTL1KMT2ANMT1MCL1EGLN1
SCHEMBL20356426 0.74 L3MBTL1 (0.33) L3MBTL1NMT1MAPK8
SCHEMBL1965759 0.72 ELANE (0.48) MCL1MAPK8KDM4E
SCHEMBL13106358 0.72 GAA (0.32) NMT1MAPK8
SCHEMBL21226504 0.71 PDK1 (0.42) KMT2ALMNAKDM4EGRNSORT1
SCHEMBL4040813 0.71 HSD17B10 (0.41) KMT2AKDM4EGRNSORT1
SCHEMBL30976257 0.70 ALDH1A1 (0.44) L3MBTL1KMT2ALMNAMAPK8

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
WO-2025133961-A1 NITROGEN-CONTAINING HETEROARYL COMPOUNDS FOR THE TREATMENT OF CHRONIC DISEASES PFIZER INC. (US) 2025-06-26 — — WO disclosed
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