SCHEMBL17909856

SCHEMBL17909856

Cc1cc(C(N)=O)c(C)c(-c2ccc3[nH]ccc3c2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PI4K2A Q9BTU6 2/20 0.50
▸ AR P10275 1/20 0.46
▸ PTGS2 P35354 1/20 0.43
▸ BRD4 O60885 1/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ RIPK2 O43353 1/20 0.41
▸ IKBKB O14920 4/20 0.40
▸ CHUK O15111 4/20 0.40
▸ POLQ O75417 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ CCNC P24863 1/20 0.40
▸ CDK8 P49336 1/20 0.40
▸ SYK P43405 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ PDE4B Q07343 1/20 0.39
▸ PARP10 Q53GL7 1/20 0.39
▸ PARP11 Q9NR21 1/20 0.39

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
SCHEMBL16881492 0.88 PI4K2A (0.46) PI4K2AARPTGS2BRD4CA12
SCHEMBL17909825 0.88 PI4K2A (0.46) PI4K2AARPTGS2BRD4CA12
SCHEMBL16881549 0.84 PI4K2A (0.49) PI4K2AARPTGS2BRD4CA12
SCHEMBL16881113 0.76 AR (0.51) PI4K2AARPTGS2BRD4CA12
SCHEMBL8523957 0.75 PI4K2A (0.51) PI4K2AARPTGS2CA12CA1
SCHEMBL17909801 0.74 PI4K2A (0.50) PI4K2AARPTGS2BRD4CA12
SCHEMBL17909823 0.74 AR (0.48) ARIKBKBCHUKCCNCCDK8
SCHEMBL23704322 0.73 PDE4B (0.53) PI4K2AARPTGS2BRD4CA12
SCHEMBL17909865 0.73 AR (0.49) ARNPC1SYKRAB9A
SCHEMBL16881110 0.73 AR (0.46) PI4K2AARPTGS2BRD4CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200031799-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2020-01-30 — — US disclosed
US-10266515-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2019-04-23 — — US disclosed
US-20180170906-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2018-06-21 — — US disclosed
US-9611252-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2017-04-04 — — US disclosed
US-20160200704-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2016-07-14 — — 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 (4 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-20200031799-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 PI4K2A 1569/4885AR 3425/4885PTGS2 174/4885
US-20180170906-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 PI4K2A 1569/4885AR 3425/4885PTGS2 174/4885
US-20160200704-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 PI4K2A 1569/4885AR 3425/4885PTGS2 174/4885
US-10266515-B2 Therapeutic inhibitory compounds KLKB1, SERPINB1, SERPINE1 PI4K2A 1569/4885AR 3425/4885PTGS2 174/4885

“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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