SCHEMBL344535

SCHEMBL344535

CCCCCCCc1ccc2c(C(=O)O)cccc2c1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.59
KAT8 Q9H7Z6 2/20 0.59
PPARG P37231 2/20 0.56
DHODH Q02127 1/20 0.53
PLK1 P53350 5/20 0.52
PTPN1 P18031 1/20 0.51
RARB P10826 5/20 0.51
RARA P10276 1/20 0.51
RARG P13631 1/20 0.51
PLK3 Q9H4B4 3/20 0.50
TBXAS1 P24557 1/20 0.49

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
SCHEMBL344421 1.00 PPARA (0.59) PPARAKAT8PPARGDHODHPLK1
SCHEMBL344105 0.99 KAT8 (0.57) PPARAKAT8PPARGDHODHPLK1
SCHEMBL343983 0.94 PTPN1 (0.54) PPARAKAT8PPARGDHODHPLK1
SCHEMBL25223402 0.89 PPARA (0.59) PPARAKAT8PPARGPLK1RARB
SCHEMBL343405 0.88 PTPN1 (0.57) PPARAKAT8PPARGDHODHPTPN1
SCHEMBL12503256 0.87 DHODH (0.59) PPARAKAT8PPARGDHODHPTPN1
SCHEMBL25253653 0.86 KAT8 (0.67) PPARAKAT8PPARGDHODHPLK1
SCHEMBL344375 0.85 DHODH (0.55) PPARAKAT8PPARGDHODHPLK1
SCHEMBL12065209 0.85 THRA (0.55) PPARAKAT8PPARGDHODHPLK1
SCHEMBL345277 0.85 DHODH (0.55) PPARAKAT8PPARGDHODHPLK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9714238-B2 Therapeutic agents for ocular hypertension ALLERGAN, INC. (US) 2017-07-25 US disclosed
US-20160340347-A9 THERAPEUTIC AGENTS FOR OCULAR HYPERTENSION ALLERGAN, INC. (US) 2016-11-24 US disclosed
US-20150175586-A1 THERAPEUTIC AGENTS FOR OCULAR HYPERTENSION ALLERGAN, INC. (US) 2015-06-25 US disclosed
US-8633220-B2 Therapeutic agents for ocular hypertension ALLERGAN, INC. (US) 2014-01-21 US disclosed
US-20120015978-A1 THERAPEUTIC AGENTS FOR OCULAR HYPERTENSION ALLERGAN, INC. (US) 2012-01-19 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 (3 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-20150175586-A1 THERAPEUTIC AGENTS FOR OCULAR HYPERTENSION PTGIR, NHERF1, PTGS1 PPARA 664/4885KAT8 2848/4885PPARG 558/4885
US-20160340347-A9 THERAPEUTIC AGENTS FOR OCULAR HYPERTENSION PTGIR, NHERF1, PTGS1 PPARA 664/4885KAT8 2848/4885PPARG 558/4885
US-20120015978-A1 THERAPEUTIC AGENTS FOR OCULAR HYPERTENSION PTGIR, NHERF1, PTGS1 PPARA 664/4885KAT8 2848/4885PPARG 558/4885

“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.