SCHEMBL31707236

SCHEMBL31707236

CCOC(=O)c1nc(C(C)C)n2c1CNC[C@H]2C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.39
▸ TP53 P04637 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ RCE1 Q9Y256 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ ADORA3 P0DMS8 2/20 0.32
▸ ADORA2A P29274 2/20 0.32
▸ ADORA1 P30542 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ KDM5B Q9UGL1 1/20 0.32
▸ CYP1A2 P05177 3/20 0.32
▸ GABRG2 P18507 1/20 0.32
▸ GABRB3 P28472 1/20 0.32
▸ GABRA5 P31644 1/20 0.32
▸ CYP3A4 P08684 2/20 0.31

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
Hydrochloric Acid SCHEMBL31699797 0.99 KMT2A (0.38) KMT2ATP53ALOX12RCE1KDM4E
SCHEMBL31707250 0.81 — —
Hydrochloric Acid SCHEMBL31699217 0.75 KMT2A (0.34) KMT2AKDM4EALDH1A1ADORA3ADORA2A
SCHEMBL31700220 0.73 ADORA1 (0.38) KMT2ATP53KDM4EALDH1A1ADORA1
Hydrochloric Acid SCHEMBL31700287 0.71 MEN1 (0.39) KMT2AALDH1A1MEN1
Acetic Acid SCHEMBL31700149 0.69 GABRG2 (0.40) KMT2AALDH1A1MEN1CYP1A2GABRG2
SCHEMBL17438038 0.69 ALDH1A1 (0.44) KMT2AKDM4EALDH1A1LMNAMEN1
SCHEMBL21914384 0.69 LMNA (0.36) KMT2ATP53ALOX12KDM4EALDH1A1
SCHEMBL31707291 0.66 — —
SCHEMBL31707018 0.66 — —

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-2025215579-A1 NOVEL NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS PFIZER INC. (US) 2025-10-16 — — WO disclosed
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