SCHEMBL2413314

SCHEMBL2413314

CC(C)(Sc1nc(CCNC(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)cs1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.57
▸ TP53 P04637 12/20 0.56
▸ MAPT P10636 6/20 0.56
▸ LMNA P02545 3/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ NPC1 O15118 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ RAB9A P51151 1/20 0.47

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
SCHEMBL12273068 0.91 RHOC (0.48) POLBTP53MAPTLMNASMN1; SMN2
SCHEMBL14106702 0.88 TP53 (0.47) POLBTP53MAPTLMNASMN1; SMN2
SCHEMBL2411290 0.84 POLB (0.42) POLBTP53MAPTLMNASMN1; SMN2
SCHEMBL2413981 0.83 POLB (0.41) POLBTP53MAPTLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL2417800 0.82 POLB (0.41) POLBTP53MAPTLMNASMN1; SMN2
SCHEMBL2419252 0.82 NPC1 (0.43) POLBTP53MAPTLMNASMN1; SMN2
SCHEMBL2413963 0.81 PPARA (0.45) TP53LMNA
SCHEMBL2413348 0.81 TP53 (0.43) POLBTP53MAPTLMNASMN1; SMN2
SCHEMBL2419925 0.81 TP53 (0.42) POLBTP53MAPTLMNASMN1; SMN2
SCHEMBL2410746 0.81 SLC22A12 (0.40) POLBTP53MAPTLMNASMN1; SMN2

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-8026370-B2 Peroxisome proliferator antagonist; hyperlipemia agents; arteriosclerosis; antiischemic agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-27 — — US claimed
US-8026370-B2 Peroxisome proliferator antagonist; hyperlipemia agents; arteriosclerosis; antiischemic agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-09-27 — — US disclosed
US-20080167307-A1 Carboxylic Acid Derivative Containing Thiazole Ring and Pharmaceutical Use Thereof MITSUBISHI PHAMA CORPORATION (JP) 2008-07-10 — — US disclosed
EP-1816128-A1 CARBOXYLIC ACID DERIVATIVE CONTAINING THIAZOLE RING AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2007-08-08 — — EP 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-20080167307-A1 Carboxylic Acid Derivative Containing Thiazole Ring and Pharmaceutical Use Thereof PPARA, PPARD, PPARG POLB 3392/4885TP53 2553/4885MAPT 3435/4885

“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.

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