SCHEMBL3555480

SCHEMBL3555480

O=C(O)c1cccc(CCCc2ccccc2NS(=O)(=O)C(F)(F)F)c1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 9/20 0.59
USP2 O75604 1/20 0.42
POLB P06746 1/20 0.42
RAB9A P51151 1/20 0.41
AKR1C3 P42330 2/20 0.41
PPM1D O15297 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
ABCB1 P08183 1/20 0.39
PTK2B Q14289 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
Benzene SCHEMBL3553377 0.85 SLC16A3 (0.61) SLC16A3POLBRAB9AAKR1C3
SCHEMBL3560711 0.85 SLC16A3 (0.61) SLC16A3POLBRAB9AAKR1C3
SCHEMBL3557901 0.84 SLC16A3 (0.64) SLC16A3USP2POLBMRGPRX4
SCHEMBL3557357 0.84 SLC16A3 (0.60) SLC16A3RAB9AAKR1C3
SCHEMBL3553371 0.84 SLC16A3 (0.60) SLC16A3RAB9AAKR1C3
SCHEMBL3557013 0.84 SLC16A3 (0.74) SLC16A3RAB9AAKR1C3PTK2B
SCHEMBL3555732 0.84 SLC16A3 (0.62) SLC16A3RAB9AMRGPRX4PTK2BSMN1; SMN2
SCHEMBL3553876 0.83 SLC16A3 (0.70) SLC16A3USP2POLBRAB9AMRGPRX4
SCHEMBL3559492 0.83 SLC16A3 (0.64) SLC16A3USP2POLBRAB9AAKR1C3
SCHEMBL3562402 0.82 SLC16A3 (0.63) SLC16A3USP2POLBRAB9APTK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816397-B2 Phenylcarboxylic acid derivatives and use thereof for the treatment of diabetes MERCK PATENT GMBH (DE) 2010-10-19 US claimed
US-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes MERCK PATENT GMBH (DE) 2008-02-21 US claimed
US-7816397-B2 Phenylcarboxylic acid derivatives and use thereof for the treatment of diabetes MERCK PATENT GMBH (DE) 2010-10-19 US disclosed
US-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes MERCK PATENT GMBH (DE) 2008-02-21 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-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes SLC5A1, ALDH7A1, ASS1 SLC16A3 425/4885USP2 3126/4885POLB 3962/4885

“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.