SCHEMBL4568581

SCHEMBL4568581

CCOc1cc2[nH]c(-c3ccc(F)cc3)c(Cc3cccc(C(=O)O)n3)c2cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
PTGER1 P34995 3/20 0.37
EGLN1 Q9GZT9 1/20 0.37
PPARG P37231 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
TSPO P30536 1/20 0.36
CYP2C19 P33261 1/20 0.36
THPO P40225 1/20 0.36

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
SCHEMBL4568580 0.95 PPARG (0.41) PTGER1PPARGMAPT
SCHEMBL4568593 0.92 MRGPRX4 (0.41) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL4568524 0.91 GRM5 (0.39) PTGER1KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL4568582 0.88 MTNR1A (0.39) PTGER1EGLN1
SCHEMBL3702859 0.88 TUBB4A (0.39) PDE4APDE4BPDE4CPDE4DPTGER1
SCHEMBL4568520 0.87 MGAM (0.38) PPARGKDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL3706168 0.86 CYP19A1 (0.41) PTGER1KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL3707080 0.86 CXCR2 (0.41) PPARGMAPT
SCHEMBL15998627 0.86 PPARG (0.37) PDE10APTGER1PPARGMAPTCAMKK1
SCHEMBL3703053 0.85 TUBB4A (0.43) PDE10A

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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R PDE10A 2672/4885PDE4A 2866/4885PDE4B 2492/4885

“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.