SCHEMBL7316008

SCHEMBL7316008

Cc1ccnc(C(=N)N(C)C)n1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.33
CYP2A6 P11509 1/20 0.31
UHRF1 Q96T88 1/20 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
SCHEMBL1670929 0.77 ALOX15 (0.41) ALOX15KMT2A
SCHEMBL38660994 0.77 ALOX15 (0.41) ALOX15KMT2A
SCHEMBL22072451 0.76 KMT2A (0.42) ALOX15KMT2ACYP2A6UHRF1
SCHEMBL28559148 0.76 ALOX15 (0.36) ALOX15KMT2ACYP2A6UHRF1
Hydrochloric Acid SCHEMBL22042734 0.74 KMT2A (0.41) ALOX15KMT2ACYP2A6
SCHEMBL108078 0.72 P2RX7 (0.36) ALOX15KMT2A
SCHEMBL23747677 0.69 ALOX15 (0.37) ALOX15KMT2AUHRF1
SCHEMBL882969 0.69 SORD (0.45) ALOX15KMT2A
SCHEMBL1578222 0.69 KMO (0.51) ALOX15KMT2A
SCHEMBL2465653 0.68 KMT2A (0.50) ALOX15KMT2A

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-4880824-A CARDIOVASCULAR DISORDERS ORTHO PHARMACEUTICAL CORPORATION (US) 1989-11-14 US disclosed