SCHEMBL17148246

SCHEMBL17148246

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.52
▸ EPHX2 P34913 2/20 0.52
▸ LMNA P02545 1/20 0.50
▸ CHRNA7 P36544 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ NAMPT P43490 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ ATR Q13535 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ THRB P10828 1/20 0.46

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
SCHEMBL17142511 0.96 KMT2A (0.54) KMT2AEPHX2LMNACHRNA7KCNH2
SCHEMBL17143130 0.95 KMT2A (0.55) KMT2AEPHX2LMNACHRNA7KCNH2
SCHEMBL17148201 0.93 KMT2A (0.55) KMT2AEPHX2LMNACHRNA7KCNH2
SCHEMBL17148175 0.93 EPHX2 (0.45) KMT2AEPHX2LMNACHRNA7KCNH2
SCHEMBL17148171 0.91 CDK1 (0.45) KMT2AEPHX2LMNACHRNA7KCNH2
SCHEMBL17148296 0.90 KIT (0.46) KMT2AEPHX2CHRNA7KCNH2SMN1; SMN2
SCHEMBL17142408 0.90 HTR3A (0.55) KMT2AEPHX2LMNACHRNA7KCNH2
SCHEMBL17148299 0.88 KMT2A (0.47) KMT2ALMNASMN1; SMN2ALDH1A1POLB
SCHEMBL17142827 0.88 KMT2A (0.56) KMT2AEPHX2LMNANAMPTPOLB
SCHEMBL17142833 0.87 EPHX2 (0.66) KMT2AEPHX2LMNANAMPTSMN1; SMN2

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 KMT2A 2525/4885EPHX2 2065/4885LMNA 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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