SCHEMBL17148153

SCHEMBL17148153

O=C(Nc1ccc(NC(=O)c2[nH]cnc2C(=O)NCCN2CCCCC2)cc1)c1ccc(F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 3/20 0.49
▸ KMT2A Q03164 1/20 0.45
▸ LMNA P02545 1/20 0.43
▸ KIT P10721 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ NAMPT P43490 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ BCL3 P20749 1/20 0.41
▸ HTT P42858 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
SCHEMBL17142872 0.97 EPHX2 (0.47) EPHX2KMT2ALMNAKITALDH1A1
SCHEMBL17142435 0.96 EPHX2 (0.48) EPHX2KMT2ALMNAKITCNR1
SCHEMBL17148308 0.94 KMT2A (0.48) EPHX2KMT2ALMNAKITALDH1A1
SCHEMBL19840635 0.94 EPHX2 (0.45) EPHX2KMT2ALMNAKITALDH1A1
SCHEMBL17148295 0.93 EPHX2 (0.47) EPHX2LMNAKITALDH1A1MAPT
SCHEMBL18396142 0.93 HTR3A (0.46) EPHX2KMT2ALMNAPOLBMAPT
SCHEMBL17142411 0.92 NAMPT (0.47) EPHX2KMT2ALMNAPOLBMAPT
SCHEMBL17148279 0.91 EPHX2 (0.44) EPHX2KMT2ALMNAKITALDH1A1
SCHEMBL17143141 0.91 HTR3A (0.48) EPHX2KMT2ALMNAPOLBMAPT
SCHEMBL18394619 0.91 KMT2A (0.43) EPHX2KMT2ALMNAPOLBMAPT

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-9884063-B2 Amido-substituted azole compounds BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-02-06 — — US disclosed
US-9884063-B2 Amido-substituted azole compounds BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-02-06 — — US disclosed
US-20170020886-A1 AMIDO-SUBSTITUTED AZOLE COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-01-26 — — US disclosed
WO-2015150449-A2 AMIDO-SUBSTITUTED AZOLE COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-10-08 — — 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 (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-20170020886-A1 AMIDO-SUBSTITUTED AZOLE COMPOUNDS TNK1, TNNI3K, TNKS EPHX2 2065/4885KMT2A 2525/4885LMNA 1257/4885

“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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