SCHEMBL4968858

SCHEMBL4968858

COC(=O)CN1C(=O)C(C)(C)Oc2c(C(C)C)cccc21

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.47
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
ALDH1A1 P00352 7/20 0.44
USP2 O75604 1/20 0.42
OPRL1 P41146 2/20 0.42
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TP53 P04637 1/20 0.40

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
SCHEMBL4968218 0.89 POLB (0.38) POLBCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL4969816 0.87 ELANE (0.38) POLBALDH1A1USP2LMNAGAA
SCHEMBL4973353 0.80 MEN1 (0.38) POLBALDH1A1LMNAGAAMEN1
SCHEMBL4969646 0.78 POLB (0.61) POLBCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL4970803 0.78 ALOX12 (0.47) POLBALDH1A1USP2LMNAMEN1
SCHEMBL4970662 0.76 MEN1 (0.41) POLBALDH1A1OPRL1LMNAMEN1
SCHEMBL10358621 0.76 MEN1 (0.41) POLBALDH1A1OPRL1LMNAMEN1
SCHEMBL10358622 0.75 ALDH1A1 (0.36) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL4968677 0.75 MAPK1 (0.46) POLBALDH1A1LMNAGAAL3MBTL1
SCHEMBL4970655 0.73 TSHR (0.40) POLBALDH1A1OPRL1LMNAL3MBTL1

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
EP-1985297-A1 CARBOXYLIC ACID COMPOUND AND USE THEREOF Japan Tobacco, Inc. (JP) 2008-10-29 EP disclosed
US-20070197512-A1 Carboxylic Acid Compounds and Use Thereof JAPAN TOBACCO INC. (JP) 2007-08-23 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-20070197512-A1 Carboxylic Acid Compounds and Use Thereof GLS, SLC10A1, SOAT1 POLB 4733/4885CYP1A2 1140/4885CYP2C9 1071/4885

“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.