SCHEMBL20988917

SCHEMBL20988917

CS(=O)(=O)NC1CCN(C(=O)CCc2ccc3c(c2)OCO3)CC1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.54
▸ LMNA P02545 6/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ HTT P42858 2/20 0.52
▸ ALDH1A1 P00352 4/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ POLB P06746 1/20 0.49
▸ EPHX2 P34913 1/20 0.48
▸ TSHR P16473 2/20 0.48
▸ MMP1 P03956 1/20 0.47
▸ MMP7 P09237 1/20 0.47
▸ MMP8 P22894 1/20 0.47
▸ MMP12 P39900 1/20 0.47
▸ MMP13 P45452 1/20 0.47
▸ MCHR1 Q99705 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ MAPK1 P28482 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
SCHEMBL20988926 0.81 ALDH1A1 (0.57) TRPV1LMNASMN1; SMN2HTTALDH1A1
SCHEMBL9425805 0.79 TRPV1 (0.81) TRPV1LMNASMN1; SMN2HTTALDH1A1
SCHEMBL20988923 0.78 C3AR1 (0.46) ALDH1A1MEN1KMT2APOLBKDM4E
SCHEMBL20989035 0.78 FKBP1A (0.59) LMNASMN1; SMN2HTTALDH1A1MEN1
SCHEMBL2830225 0.78 TRPV1 (0.64) TRPV1LMNASMN1; SMN2ALDH1A1MEN1
SCHEMBL9425973 0.78 TRPV1 (0.83) TRPV1LMNASMN1; SMN2HTTALDH1A1
SCHEMBL20988916 0.77 KMT2A (0.48) LMNAALDH1A1KMT2APOLBTSHR
SCHEMBL20989033 0.77 SIGMAR1 (0.50) LMNASMN1; SMN2HTTALDH1A1KMT2A
SCHEMBL15985215 0.76 TRPV1 (0.61) TRPV1LMNASMN1; SMN2HTTALDH1A1
SCHEMBL14218026 0.76 TRPV1 (0.61) TRPV1LMNASMN1; SMN2HTTALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190134056-A1 K-RAS MUTATIONS AND ANTAGONISTS THE TRUSTEES OF THE STEVENS INSTITUTE OF TECHNOLOG (US) 2019-05-09 — — 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-20190134056-A1 K-RAS MUTATIONS AND ANTAGONISTS KRAS, NRAS, HRAS TRPV1 3933/4885LMNA 3462/4885SMN1; SMN2 4615/4885

“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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