SCHEMBL3472282

SCHEMBL3472282

Cc1nc2ccccc2n1S(=O)(=O)c1cc(N)ccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH3A1 P30838 8/20 0.62
PKM P14618 1/20 0.52
NOD1 Q9Y239 5/20 0.51
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA3 P07451 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
CA5A P35218 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA13 Q8N1Q1 1/20 0.47
CA14 Q9ULX7 1/20 0.47
CA5B Q9Y2D0 1/20 0.47
TSHR P16473 3/20 0.46
CXCL8 P10145 3/20 0.45
NOD2 Q9HC29 2/20 0.45

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
SCHEMBL13032907 0.83 ALDH3A1 (0.60) ALDH3A1PKMNOD1LMNASMN1; SMN2
SCHEMBL3473099 0.82 ALDH3A1 (0.59) ALDH3A1PKMLMNASMN1; SMN2CA12
SCHEMBL3470253 0.81 ALOX5 (0.65) ALDH3A1PKMNOD1LMNASMN1; SMN2
SCHEMBL3470525 0.79 ALDH3A1 (0.57) ALDH3A1PKMLMNASMN1; SMN2CA12
SCHEMBL13077259 0.79 ALDH3A1 (0.57) ALDH3A1PKMNOD1LMNASMN1; SMN2
SCHEMBL13076785 0.78 ALDH3A1 (0.55) ALDH3A1PKMNOD1LMNASMN1; SMN2
SCHEMBL13076783 0.78 ALDH3A1 (0.55) ALDH3A1PKMNOD1LMNASMN1; SMN2
SCHEMBL3470817 0.78 ALDH1A1 (0.58) ALDH3A1PKMNOD1LMNASMN1; SMN2
SCHEMBL3634978 0.72 SMN1; SMN2 (0.66) ALDH3A1PKMNOD1LMNASMN1; SMN2
SCHEMBL22462449 0.69 SMN1; SMN2 (0.66) ALDH3A1PKMNOD1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317706-A1 HNF4alpha MODULATORS AND METHODS OF USE BUMHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-12-16 US disclosed
US-20100317706-A1 HNF4alpha MODULATORS AND METHODS OF USE BUMHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-12-16 US disclosed
US-20100317706-A1 HNF4alpha MODULATORS AND METHODS OF USE BUMHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-12-16 US disclosed
WO-2010127246-A2 HNF4 MODULATORS AND METHODS OF USE BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-11-04 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-20100317706-A1 HNF4alpha MODULATORS AND METHODS OF USE HNF4A, NCOA4, NR4A3 ALDH3A1 865/4885PKM 3891/4885NOD1 4161/4885

“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.