SCHEMBL2319936

SCHEMBL2319936

O=C(O)c1cc(O)n(-c2ccc(F)c(Cl)c2)n1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RPA1 P27694 11/20 0.54
▸ KMT2A Q03164 3/20 0.51
▸ MEN1 O00255 2/20 0.50
▸ ATM Q13315 1/20 0.50
▸ MARS1 P56192 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ PPP1CA P62136 2/20 0.48
▸ L3MBTL1 Q9Y468 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
SCHEMBL955390 0.87 KMT2A (0.50) RPA1KMT2AMEN1ATMSMN1; SMN2
SCHEMBL2318841 0.83 RPA1 (0.68) RPA1KMT2AMEN1ATMMARS1
SCHEMBL1765068 0.82 PPP1CA (0.71) RPA1KMT2AMEN1ATMMARS1
SCHEMBL2319966 0.82 PPP1CA (0.68) RPA1KMT2AMEN1MARS1SMN1; SMN2
SCHEMBL16921433 0.80 KMT2A (0.61) RPA1KMT2AMEN1ATMMARS1
SCHEMBL1764965 0.80 RPA1 (0.65) RPA1KMT2AMEN1ATMMARS1
SCHEMBL1765503 0.79 RPA1 (0.61) RPA1KMT2AMEN1ATMMARS1
SCHEMBL1765454 0.79 RPA1 (0.65) RPA1KMT2AMEN1ATMMARS1
SCHEMBL1526212 0.78 RPA1 (0.61) RPA1KMT2AMEN1ATMMARS1
SCHEMBL31522197 0.78 ALDH1A1 (0.44) L3MBTL1

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-20140128616-A1 OXYGEN-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2014-05-08 — — US disclosed
US-8664257-B2 Oxygen-substituted 3-heteroaroylamino-propionic acid derivatives and their use as pharmaceuticals SANOFI (FR) 2014-03-04 — — US disclosed
US-20130046004-A1 OXYGEN-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2013-02-21 — — US disclosed
EP-2528902-A1 OXYGEN-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2012-12-05 — — EP disclosed
WO-2011092187-A1 OXYGEN-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2011-08-04 — — WO 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 (2 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-20130046004-A1 OXYGEN-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS CTSF, CTSS, CTSE RPA1 4448/4885KMT2A 4267/4885MEN1 4729/4885
US-20140128616-A1 OXYGEN-SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS CTSF, CTSS, CTSE RPA1 4448/4885KMT2A 4267/4885MEN1 4729/4885

“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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