SCHEMBL24928207

SCHEMBL24928207

C=C(C(C)C)N1CCCC(C(C)C)C1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.33
CPN1 P15169 1/20 0.32
CPB2 Q96IY4 1/20 0.32
PLAT P00750 1/20 0.32
GAA P10253 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 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
SCHEMBL19618184 0.83 HPGD (0.33) HPGDCPN1CPB2PLAT
SCHEMBL22305382 0.83 HPGD (0.33) HPGDCPN1CPB2PLAT
SCHEMBL16849113 0.79 ALDH1A1 (0.47) HPGDGAA
SCHEMBL23153413 0.79 CA12 (0.47)
SCHEMBL13328191 0.79 CA1 (0.36) GAACYP2C9CYP2C19
SCHEMBL19999888 0.79 HPGD (0.32) HPGDCPN1CPB2PLAT
SCHEMBL15576296 0.78 CHRNB2 (0.43) HPGDCPN1CPB2PLAT
SCHEMBL12026419 0.78 CHRNB2 (0.43) HPGDCPN1CPB2PLAT
SCHEMBL19352913 0.77 JAK3 (0.37) HPGDCPN1CPB2PLATGAA
SCHEMBL20082893 0.77 JAK3 (0.37) HPGDCPN1CPB2PLATGAA

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-2023008885-A1 PYRROLOPYRIMIDINE DERIVATIVE COMPOUND AND USE THEREOF 보로노이바이오 주식회사 2023-02-02 WO disclosed