SCHEMBL19639691

SCHEMBL19639691

C=CCn1cc(C(=O)OC)c2ccn(S(=O)(=O)c3ccc(C)cc3)c2c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.48
▸ HPGD P15428 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ ALOX5 P09917 2/20 0.39
▸ BRD4 O60885 4/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ PTGS2 P35354 1/20 0.37
▸ HSD17B10 Q99714 3/20 0.36
▸ NR4A2 P43354 1/20 0.36
▸ VEGFA P15692 1/20 0.36
▸ EGLN1 Q9GZT9 1/20 0.36

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
SCHEMBL19639679 0.84 ALDH1A1 (0.41) ALDH1A1HPGDLMNAUSP2MAPK1
SCHEMBL17753721 0.83 BRD4 (0.50) ALDH1A1HPGDLMNAUSP2MEN1
SCHEMBL17758546 0.81 CA1 (0.42) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL29455808 0.75 BRD4 (0.36) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL17753871 0.74 NR4A2 (0.44) MAPK1MEN1KMT2AALOX5CA1
SCHEMBL19640352 0.73 BRD4 (0.59) BRD4
SCHEMBL30073414 0.73 BRD4 (0.59) BRD4
SCHEMBL16382681 0.73 MEN1 (0.43) LMNAMAPK1MEN1KMT2AALOX5
SCHEMBL17758613 0.73 BRD9 (0.42) BRD4
SCHEMBL17754093 0.72 BRD4 (0.39) ALOX5BRD4PTGS2VEGFAEGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 — — US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 — — 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 (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-10258603-B2 Therapeutic compounds and uses thereof BRD4, BRDT, BRD3 ALDH1A1 1563/4885HPGD 1204/4885LMNA 2473/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 ALDH1A1 1563/4885HPGD 1204/4885LMNA 2473/4885

“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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