SCHEMBL21202625

SCHEMBL21202625

COC(=O)c1ccc(S(=O)(=O)N2C(Cc3c[nH]cn3)C(=O)NC23CCN(C)CC3)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.38
▸ CYP2C9 P11712 1/20 0.36
▸ FBP1 P09467 1/20 0.35
▸ GAA P10253 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ TSHR P16473 3/20 0.34
▸ USP5 P45974 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ ADRB2 P07550 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CRBN Q96SW2 2/20 0.34
▸ NEK2 P51955 1/20 0.34
▸ CTSG P08311 1/20 0.33
▸ CMA1 P23946 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ DDB1 Q16531 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL12656338 0.91 LMNA (0.41) GAAPOLBUSP5MAPTKMT2A
SCHEMBL21325177 0.84 HSD11B1 (0.34) —
SCHEMBL12656063 0.84 LMNA (0.43) GAAPOLBTSHRMAPTKMT2A
SCHEMBL12656286 0.82 ALDH1A1 (0.40) GAAPOLBMAPTALDH1A1LMNA
SCHEMBL13363631 0.81 GPR119 (0.39) —
SCHEMBL12623912 0.75 HRH3 (0.41) MAPTALDH1A1LMNASMN1; SMN2
SCHEMBL20787994 0.74 NEK2 (0.30) NEK2
SCHEMBL12626404 0.64 LMNA (0.43) POLBTSHRMAPTALDH1A1LMNA
SCHEMBL12655651 0.64 LMNA (0.36) POLBTSHRMAPTALDH1A1LMNA
SCHEMBL19602435 0.64 GLA (0.76) GLACYP2C9FBP1POLBTSHR

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-10363239-B2 Method for inhibiting growth of cancer cells PAIN THERAPEUTICS (US) 2019-07-30 — — 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-10363239-B2 Method for inhibiting growth of cancer cells FLNA, FLNB, FSCN1 GLA 4790/4885CYP2C9 4293/4885FBP1 593/4885

“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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