SCHEMBL18148221

SCHEMBL18148221

COc1c2c(cc(NS(=O)(=O)c3nccs3)c1OCC(N)=O)C(=O)C(=O)N2

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 1/20 0.34
▸ SCN9A Q15858 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ LMNA P02545 2/20 0.31
▸ BRD4 O60885 2/20 0.30
▸ MAPT P10636 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ NAMPT P43490 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
SCHEMBL18147986 0.86 SLC40A1 (0.33) SLC40A1MEN1ALDH1A1PKMKMT2A
SCHEMBL18147974 0.83 CNKSR1 (0.42) SLC40A1MEN1ALDH1A1PKMKMT2A
SCHEMBL18147970 0.83 CNKSR1 (0.42) SLC40A1MEN1ALDH1A1PKMKMT2A
SCHEMBL18148058 0.72 PTGS1 (0.40) KDM4EMEN1ALDH1A1KMT2ALMNA
SCHEMBL7081766 0.59 NLRP3 (0.50) SLC40A1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL7686448 0.58 ALDH1A1 (0.38) KDM4EALDH1A1PKMMAPTSMN1; SMN2
SCHEMBL28291561 0.56 SLC40A1 (0.50) SLC40A1KDM4EMEN1ALDH1A1PKM
SCHEMBL18710026 0.55 SLC40A1 (0.46) SLC40A1KDM4EMEN1ALDH1A1PKM
SCHEMBL8229998 0.55 SLC40A1 (0.46) SLC40A1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL11037434 0.55 SLC40A1 (0.54) SLC40A1MEN1ALDH1A1PKMKMT2A

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-10227356-B2 Compounds, compositions and methods for inhibiting CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2019-03-12 — — US disclosed
US-10227356-B2 Compounds, compositions and methods for inhibiting CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2019-03-12 — — US disclosed
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2016-10-20 — — US disclosed
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2016-10-20 — — 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-10227356-B2 Compounds, compositions and methods for inhibiting CNKSR1 CNKSR1, CAMKK1, CNR1 SLC40A1 4767/4885SCN9A 2085/4885KDM4E 1388/4885
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 CNKSR1, CAMKK1, CNR1 SLC40A1 4767/4885SCN9A 2085/4885KDM4E 1388/4885

“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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