SCHEMBL20248221

SCHEMBL20248221

NC(=O)CCCc1cn(Cc2ccc(F)cc2)c2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ POLB P06746 3/20 0.61
▸ RXFP1 Q9HBX9 2/20 0.60
▸ ALDH1A1 P00352 3/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ TP53 P04637 2/20 0.55
▸ LMNA P02545 1/20 0.55
▸ HTT P42858 2/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ MAPT P10636 1/20 0.54
▸ PADI4 Q9UM07 1/20 0.54
▸ CYP19A1 P11511 2/20 0.52

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
SCHEMBL20250911 0.90 RXFP1 (0.62) MEN1KMT2APOLBRXFP1ALDH1A1
SCHEMBL8696232 0.81 POLB (0.55) MEN1KMT2APOLBRXFP1ALDH1A1
SCHEMBL8805799 0.81 YES1 (0.74) MEN1KMT2APOLBRXFP1ALDH1A1
SCHEMBL5329307 0.81 POLB (0.72) POLBALDH1A1LMNAPADI4CYP19A1
SCHEMBL1233547 0.80 ALDH1A1 (0.67) MEN1KMT2APOLBRXFP1ALDH1A1
SCHEMBL16977268 0.79 CYP19A1 (0.61) MEN1KMT2APOLBRXFP1ALDH1A1
SCHEMBL20248189 0.78 HTR6 (0.62) POLBTP53MAPT
SCHEMBL24479703 0.76 LMNA (0.77) MEN1KMT2APOLBRXFP1TP53
SCHEMBL9054761 0.76 YES1 (0.83) MEN1KMT2APOLBRXFP1ALDH1A1
SCHEMBL1859925 0.76 POLB (0.64) MEN1KMT2APOLBTP53MAPT

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-20180161313-A1 Inhibitors of Mcl-1 as Drugs to Overcome Resistance to BRAF Inhibitors and MEK Inhibitors TEXAS TECH UNIVERSITY SYSTEM 2018-06-14 — — US disclosed
US-20180161313-A1 Inhibitors of Mcl-1 as Drugs to Overcome Resistance to BRAF Inhibitors and MEK Inhibitors TEXAS TECH UNIVERSITY SYSTEM 2018-06-14 — — 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-20180161313-A1 Inhibitors of Mcl-1 as Drugs to Overcome Resistance to BRAF Inhibitors and MEK Inhibitors MCL1, BRAF, RAF1 MEN1 778/4885KMT2A 1550/4885POLB 1447/4885

“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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