SCHEMBL28382736

SCHEMBL28382736

CCCCCCCCCC(=O)Oc1cc2c(=O)oc3cc(C(CCCCCCCC)C(=O)O)ccc3c2cc1OC(=O)CCCCCCCCC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 1/20 0.39
ALOX15 P16050 1/20 0.39
POLM Q9NP87 1/20 0.37
POLK Q9UBT6 1/20 0.37
POLL Q9UGP5 1/20 0.37
POLH Q9Y253 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
TOP2A P11388 1/20 0.35
SRC P12931 2/20 0.35
ELANE P08246 1/20 0.35
SLC10A1 Q14973 1/20 0.35

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
SCHEMBL20581664 1.00 FPR1 (0.39) FPR1ALOX15POLMPOLKPOLL
SCHEMBL20582005 0.82 ALDH1A1 (0.53) FPR1ALOX15KMT2AMEN1KDM4E
SCHEMBL20581666 0.82 ALDH1A1 (0.53) FPR1ALOX15KMT2AMEN1KDM4E
SCHEMBL4247248 0.75 ALDH1A1 (0.48) KMT2AMEN1KDM4EALDH1A1GLA
SCHEMBL22076346 0.74 ALDH1A1 (0.62) KMT2AMEN1KDM4EALDH1A1GLA
SCHEMBL19999162 0.73 ALOX15 (0.59) ALOX15POLMPOLKPOLLPOLH
SCHEMBL28382576 0.71 KMT2A (0.40) KMT2AMEN1KDM4EALDH1A1GLA
SCHEMBL20581618 0.70 BCHE (0.33) ALOX15KMT2AMEN1KDM4EALDH1A1
SCHEMBL3952916 0.70 ALDH1A1 (0.44) KMT2AMEN1KDM4EALDH1A1GLA
SCHEMBL29833573 0.70 KMT2A (0.47) KMT2AMEN1ALDH1A1

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
CN-110869024-A Multi-biological agents and methods of use thereof 旗舰创业创新五公司 2020-03-06 CN disclosed