SCHEMBL15099971

SCHEMBL15099971

CCc1ccc2[nH]c(C(=O)NC(CO)C(C)(C)C)cc2c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.57
▸ KMT2A Q03164 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ MAPT P10636 2/20 0.49
▸ EGFR P00533 1/20 0.46
▸ DRD2 P14416 1/20 0.44
▸ PYGL P06737 9/20 0.44
▸ PYGM P11217 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ HPGD P15428 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ NHERF1 O14745 2/20 0.42
▸ GAA P10253 1/20 0.41

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
SCHEMBL14845704 0.86 TP53 (0.54) KDM4ENPC1RAB9AMAPTEGFR
SCHEMBL19085805 0.84 EGFR (0.44) KDM4ENPC1RAB9AMAPTEGFR
SCHEMBL12827225 0.82 KDM4E (0.64) KDM4EKMT2AMEN1NPC1RAB9A
SCHEMBL12826973 0.80 KDM4E (0.64) KDM4EKMT2AMEN1NPC1RAB9A
SCHEMBL12846301 0.78 KDM4E (0.69) KDM4EKMT2AMEN1NPC1RAB9A
SCHEMBL13222833 0.78 CA12 (0.41) KDM4ENPC1RAB9AMAPTEGFR
SCHEMBL17149665 0.76 ADRB2 (0.58) KDM4EKMT2AMEN1NPC1RAB9A
SCHEMBL15099964 0.76 KDM4E (0.79) KDM4EKMT2AMEN1NPC1RAB9A
SCHEMBL13204716 0.74 MAPT (0.57) KDM4EKMT2AMEN1NPC1RAB9A
SCHEMBL6517075 0.74 KDM4E (0.63) KDM4EKMT2AMEN1NPC1RAB9A

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
US-8952049-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-02-10 — — US disclosed
US-20130178471-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS Vextex Pharmaceuticals Incorporated (US) 2013-07-11 — — 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-20130178471-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 KDM4E 4235/4885KMT2A 4313/4885MEN1 4687/4885

“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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