SCHEMBL31606261

SCHEMBL31606261

CC1(C)c2ccccc2Nc2ccc(C(=O)O)cc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.49
▸ PDK2 Q15119 2/20 0.47
▸ PDK4 Q16654 1/20 0.47
▸ PGR P06401 1/20 0.40
▸ RARB P10826 5/20 0.39
▸ RARG P13631 5/20 0.39
▸ RARA P10276 4/20 0.39
▸ CYP26A1 O43174 2/20 0.39
▸ CYP26B1 Q9NR63 1/20 0.39
▸ RXRA P19793 2/20 0.39
▸ RXRB P28702 1/20 0.39
▸ RXRG P48443 1/20 0.39
▸ SRD5A2 P31213 1/20 0.38
▸ GAA P10253 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA4 P22748 1/20 0.38

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
SCHEMBL1874397 0.80 PGR (0.55) PDK2PDK4PGRCA12CA2
SCHEMBL13269073 0.77 PDK2 (0.53) PDK2RARBRARGRXRASRD5A2
SCHEMBL30340691 0.77 PDK2 (0.53) PDK2RARBRARGRXRASRD5A2
SCHEMBL31605981 0.77 SIGMAR1 (0.51) PDK2
SCHEMBL31606228 0.77 PDK2 (0.42) PDK2PDK4KDM4ELMNAALDH1A1
SCHEMBL12723263 0.77 PDK2 (0.57) ALOX5PDK2PDK4PGRGAA
SCHEMBL29371027 0.76 PDK2 (0.67) ALOX5PDK2PDK4GAATDP1
SCHEMBL31911 0.76 PDK2 (0.67) ALOX5PDK2PDK4GAATDP1
SCHEMBL12109350 0.75 PDK2 (0.52) PDK2PDK4PGR
SCHEMBL25012048 0.75 PDK2 (0.55) ALOX5PDK2PDK4PGRGAA

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-2025110809-A1 NOVEL DIHYDROACRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 미토이뮨테라퓨틱스 2025-05-30 — — WO disclosed
Send feedback