SCHEMBL17192045

SCHEMBL17192045

Cc1cc2ncn(CC34CCN(CC3)CC4)c(=O)c2c(Cl)c1C

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KCNH2 Q12809 1/20 0.32
LMNA P02545 2/20 0.31
MAPT P10636 1/20 0.31
USP7 Q93009 4/20 0.31
HTR1A P08908 4/20 0.31
HTR7 P34969 3/20 0.31
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
ENPP2 Q13822 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL17192041 0.75 TNF (0.47) TNFMEN1KMT2AKCNH2LMNA
SCHEMBL17192042 0.74 TNF (0.43) TNFLMNAHTR1AHTR7TP53
SCHEMBL17181555 0.73 TNF (0.39) TNFMEN1KMT2ALMNAMAPT
SCHEMBL17181429 0.68 TNF (0.38) TNFKMT2AUSP7ALDH1A1
SCHEMBL15680553 0.62 HDAC6 (0.45) KMT2AUSP7
SCHEMBL24879062 0.57 KMT2A (0.51) TNFMEN1KMT2ALMNAMAPT
SCHEMBL15670992 0.56 TNF (0.41) TNFMAPT
SCHEMBL30987284 0.56 HSD17B13 (0.38) USP7USP2ALDH1A1MAPK1
SCHEMBL15671151 0.55 TNF (0.45) TNFMAPT
SCHEMBL15670874 0.55 TNF (0.72) TNFMAPTHTR1AALDH1A1

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-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 US disclosed
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LTD (GB) 2015-10-22 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 (2 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 TNF 2990/4885MEN1 3926/4885KMT2A 1116/4885
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS CEP170, ABL1, CEPT1 TNF 1673/4885MEN1 3214/4885KMT2A 1566/4885

“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.