SCHEMBL19050656

SCHEMBL19050656

BC1(S(=O)(=O)NC(CCCCCCC)CCCCCCC)CCCCC1

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
FAAH O00519 2/20 0.31
ITGB1 P05556 1/20 0.31
ITGA4 P13612 1/20 0.31
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 1/20 0.30
ADH4 P08319 1/20 0.30
ADH7 P40394 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
SCHEMBL16917410 0.69 TP53 (0.41) TP53FAAHADH1BADH1CADH1A
SCHEMBL24667475 0.69 TP53 (0.41) TP53FAAHADH1BADH1CADH1A
SCHEMBL24665644 0.69 TP53 (0.41) TP53FAAHADH1BADH1CADH1A
SCHEMBL12656353 0.68 TP53 (0.39) TP53ADH1BADH1CADH1AADH4
SCHEMBL11335725 0.67 TP53 (0.42) TP53FAAHADH1BADH1CADH1A
SCHEMBL12656354 0.66 TP53 (0.38) TP53FAAHADH1BADH1CADH1A
SCHEMBL1085797 0.66 ZDHHC7 (0.36) TP53ADH1BADH1CADH1AADH4
SCHEMBL15632534 0.65 TP53 (0.41) TP53ADH1BADH1CADH1AADH4
SCHEMBL9290259 0.65 NPSR1 (0.30)
SCHEMBL25519813 0.64 EPHX1 (0.55) TP53FAAHADH1BADH1CADH1A

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-20170183333-A1 DERIVATIVES OF N-(ARYLAMINO) SULFONAMIDES AS INHIBITORS OF MEK ARDEA BIOSCIENCES, INC. (US) 2017-06-29 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-20170183333-A1 DERIVATIVES OF N-(ARYLAMINO) SULFONAMIDES AS INHIBITORS OF MEK BRAF, NRAS, MAP3K2 TP53 346/4885SLC6A4 4134/4885SLC6A3 3976/4885

“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.