SCHEMBL4172798

SCHEMBL4172798

Cc1ccc(C(=O)N2CCC(O)(c3ccc(Br)cc3)CC2)cc1NS(C)(=O)=O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.57
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
CA7 P43166 3/20 0.57
CA9 Q16790 3/20 0.57
CA14 Q9ULX7 3/20 0.57
KDM4E B2RXH2 1/20 0.45
CCR1 P32246 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ACE2 Q9BYF1 1/20 0.42
HPGD P15428 2/20 0.42
PKLR P30613 1/20 0.42
TSHR P16473 1/20 0.41
FASN P49327 3/20 0.40
S1PR2 O95136 1/20 0.40
PKM P14618 1/20 0.39
RAB9A P51151 1/20 0.39
GAA P10253 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
SCHEMBL4172413 0.90 KDM4E (0.58) CA12CA1CA2CA7CA9
SCHEMBL4181151 0.89 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL4183383 0.87 CYP2C9 (0.44) CA12CA1CA2CA7CA9
SCHEMBL4177346 0.85 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL4193612 0.81 FASN (0.49) CA12CA1CA2CA7CA9
SCHEMBL4186712 0.81 PKLR (0.55) KDM4ESMN1; SMN2HPGDPKLRTSHR
SCHEMBL4187265 0.80 PKLR (0.52) PKLR
SCHEMBL4199044 0.80 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4179408 0.80 FASN (0.59) HPGDFASN
SCHEMBL4191661 0.78 FASN (0.49) CA12CA1CA2CA7CA9

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-20090105305-A1 Therapeutic Agents - 550 ASTRAZENECA AB (SE) 2009-04-23 US disclosed
WO-2008075070-A1 SULFONAMIDE DERIVATIVES FOR THERAPEUTIC USE AS FATTY ACID SYNTHASE INHIBITORS ASTRAZENECA AB (SE) 2008-06-26 WO 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-20090105305-A1 Therapeutic Agents - 550 FABP4, GPR119, FASN CA12 2949/4885CA1 3297/4885CA2 2038/4885

“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.