SCHEMBL15680668

SCHEMBL15680668

CNC(=O)C(=O)c1cc(Cl)c(O)c(O)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C2 P52895 3/20 0.35
▸ AKR1C1 Q04828 3/20 0.35
▸ AKR1C4 P17516 1/20 0.35
▸ AKR1C3 P42330 1/20 0.35
▸ TTR P02766 3/20 0.34
▸ HTT P42858 3/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ HSD17B10 Q99714 5/20 0.33
▸ HPGD P15428 4/20 0.33
▸ TSHR P16473 4/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ RECQL P46063 2/20 0.33
▸ HSPA5 P11021 2/20 0.33
▸ DHODH Q02127 1/20 0.33
▸ NPC1 O15118 1/20 0.33

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
SCHEMBL17193121 0.83 AKR1C2 (0.33) AKR1C2AKR1C1AKR1C4AKR1C3TTR
SCHEMBL15495181 0.81 WDR5 (0.41) AKR1C2AKR1C1AKR1C4AKR1C3TTR
SCHEMBL17193078 0.81 HTT (0.38) AKR1C2AKR1C1AKR1C4AKR1C3HTT
SCHEMBL19426017 0.81 POLB (0.47) AKR1C2AKR1C1AKR1C4AKR1C3HTT
SCHEMBL19426130 0.80 TTR (0.34) AKR1C2AKR1C1AKR1C4AKR1C3TTR
SCHEMBL15680157 0.79 AKR1C2 (0.38) AKR1C2AKR1C1AKR1C4AKR1C3TTR
SCHEMBL19757625 0.76 TTR (0.52) AKR1C2AKR1C1AKR1C4AKR1C3TTR
SCHEMBL17191823 0.75 AKR1C2 (0.36) AKR1C2AKR1C1AKR1C4AKR1C3TTR
SCHEMBL17193009 0.75 SELL (0.38) TTRHTTSMN1; SMN2CYP2C9HSD17B10
SCHEMBL15680141 0.75 ALDH1A1 (0.41) AKR1C2AKR1C1AKR1C4AKR1C3TTR

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-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 — — US disclosed
US-20150344502-A1 CEPHEM COMPOUND SHIONOGI & CO., LTD. (JP) 2015-12-03 — — US disclosed
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LTD (GB) 2015-10-22 — — US disclosed
WO-2014068388-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-05-08 — — 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 (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-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS CEP170, CES2, CMBL AKR1C2 3287/4885AKR1C1 3747/4885AKR1C4 3625/4885
US-20150344502-A1 CEPHEM COMPOUND PRMT6, CEP170, NR0B1 AKR1C2 3334/4885AKR1C1 3660/4885AKR1C4 3546/4885
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS CEP170, ABL1, CEPT1 AKR1C2 2706/4885AKR1C1 3386/4885AKR1C4 3084/4885

“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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