SCHEMBL2495587

SCHEMBL2495587

O=C1[CH]c2cccc(Cc3ccccc3)c2C=C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
DAO P14920 1/20 0.37
HTR2A P28223 1/20 0.37
CTRC Q99895 3/20 0.36
TSHR P16473 1/20 0.36
NR1H2 P55055 1/20 0.36
CALM1 P0DP23 1/20 0.35
HRH1 P35367 2/20 0.35
FEN1 P39748 1/20 0.35
BCL2 P10415 1/20 0.35
BCL2L1 Q07817 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL9719446 0.74 KEAP1 (0.38) HTR2ATSHRCALM1BCL2BCL2L1
SCHEMBL9719519 0.71 BCL2 (0.33) HTR2ABCL2BCL2L1
SCHEMBL217407 0.70 HTR2A (0.40) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL9719425 0.68 HSPA5 (0.37) HTR2A
SCHEMBL9719500 0.67 HSPA5 (0.35)
SCHEMBL1027006 0.67 HTR2A (0.40) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL972711 0.66 CALM1 (0.69) CYP3A4HTR2ACALM1HRH1BCL2
SCHEMBL22675719 0.65 CALM1 (0.52) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL1927673 0.65 MAPT (0.46) MAOAMAOBHTR2ATSHRHRH1
SCHEMBL9719496 0.64 IDH1 (0.31) IDH1

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-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 MAOA 637/4885MAOB 212/4885CYP1A2 804/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.