SCHEMBL4158621

SCHEMBL4158621

O=S(=O)(c1ccccc1)c1ccc2[nH]c(-c3ccc(F)cc3)cc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.51
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA9 Q16790 2/20 0.51
CYP19A1 P11511 4/20 0.47
KDM4E B2RXH2 3/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
CTSV O60911 1/20 0.46
CTSL P07711 1/20 0.46
LMNA P02545 3/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HPGD P15428 2/20 0.45
CYP1A1 P04798 2/20 0.44
PPARG P37231 1/20 0.43
HTR2A P28223 2/20 0.42

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
SCHEMBL4147377 0.90 CYP19A1 (0.56) CA12CA1CA2CA9CYP19A1
SCHEMBL4151365 0.83 HTR2A (0.48) KDM4EMEN1MAPTKMT2ALMNA
SCHEMBL4154662 0.81 FFAR1 (0.54) CA12CA1CA2CA9CYP19A1
SCHEMBL28929657 0.79 CA2 (0.77) CA12CA1CA2CA9CYP19A1
SCHEMBL4076387 0.77 CA2 (0.50) CA12CA1CA2CA9MEN1
SCHEMBL8444391 0.76 CDK5 (0.55) CA12CA1CA2CA9CYP1A1
SCHEMBL4887738 0.76 KDM4E (0.64) CYP19A1KDM4ENPC1RAB9AMEN1
SCHEMBL30869753 0.76 CYP1A1 (0.68) CYP19A1KDM4ENPC1RAB9AMEN1
SCHEMBL27915152 0.76 CYP19A1 (0.56) CA12CA1CA2CA9CYP19A1
SCHEMBL1911780 0.76 CA1 (0.70) CA12CA1CA2CA9CYP19A1

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-20090012134-A1 Arylsulfonyl Benzofused Heterocycles as 5-Ht2a Antagonists CURTIS NEIL ROY 2009-01-08 US claimed
US-20090012134-A1 Arylsulfonyl Benzofused Heterocycles as 5-Ht2a Antagonists CURTIS NEIL ROY 2009-01-08 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-20090012134-A1 Arylsulfonyl Benzofused Heterocycles as 5-Ht2a Antagonists HTR2A, HTR2C, HTR2B CA12 4870/4885CA1 4661/4885CA2 4757/4885

“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.