SCHEMBL31329261

SCHEMBL31329261

Cc1ccnc(-n2cccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.52
CCR5 P51681 1/20 0.52
CCR8 P51685 1/20 0.52
UHRF1 Q96T88 1/20 0.46
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
GRIN1 Q05586 1/20 0.46
GRIN2A Q12879 1/20 0.46
GRIN2B Q13224 1/20 0.46
GRIN2C Q14957 1/20 0.46
GRIN3A Q8TCU5 1/20 0.46
LMNA P02545 4/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NOS2 P35228 2/20 0.43
NOS3 P29474 1/20 0.43
NOS1 P29475 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43

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
SCHEMBL11983624 1.00 CCR1 (0.52) CCR1CCR5CCR8UHRF1GRIN2D
SCHEMBL12755537 0.79 LOXL2 (0.58) CCR1CCR5CCR8UHRF1LMNA
SCHEMBL26663329 0.75 ALDH1A1 (0.38) ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL14909322 0.75 GRIN2D (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12615420 0.75 KDM4C (0.37)
SCHEMBL12615424 0.75 JAK2 (0.33) GRIN1GRIN2BLMNAALDH1A1KDM4E
SCHEMBL21425513 0.75 UHRF1 (0.47) CCR1CCR5CCR8UHRF1GRIN2D
SCHEMBL21274954 0.75 CCR1 (0.52) CCR1CCR5CCR8LMNAALDH1A1
SCHEMBL30030741 0.75 UHRF1 (0.47) CCR1CCR5CCR8UHRF1GRIN2D
SCHEMBL8008287 0.75 GRM5 (0.56) CCR1CCR5CCR8UHRF1GRIN2D

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
US-20250066521-A1 Ion-Conducting Membranes GREENLYZER MATERIALS PTE. LTD. (SG) 2025-02-27 US disclosed
WO-2025042413-A1 METHODS OF OPERATING A WATER ELECTROLYZER Alchemr, Inc. (US) 2025-02-27 WO disclosed