SCHEMBL12896181

SCHEMBL12896181

CC(C)c1sc2ccc(NS(=O)(=O)c3ccccc3)cc2c1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
BRD4 O60885 1/20 0.46
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
ALDH1A1 P00352 3/20 0.44
PKM P14618 2/20 0.44
HDAC1 Q13547 1/20 0.44
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
GAA P10253 3/20 0.43
KEAP1 Q14145 2/20 0.43
IL1RN P18510 1/20 0.43
ERAP1 Q9NZ08 1/20 0.43
GFER P55789 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
TRIM24 O15164 1/20 0.42
HPGD P15428 2/20 0.42
FFAR4 Q5NUL3 1/20 0.42
KDM4E B2RXH2 1/20 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
SCHEMBL12922863 0.76 BRD4 (0.50) LMNASMN1; SMN2BRD4MEN1KMT2A
SCHEMBL12896169 0.72 KDM4E (0.47) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL26812033 0.70 FFAR4 (0.57) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL13995037 0.69 PGR (0.69) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL10169497 0.68 HTR6 (0.59) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL810795 0.67 KMT2A (0.91) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL2614387 0.67 SMN1; SMN2 (1.00) LMNASMN1; SMN2BRD4MEN1KMT2A
SCHEMBL12896160 0.67 ALB (0.38) LMNAMAPT
SCHEMBL974545 0.67 HDAC1 (0.57) LMNASMN1; SMN2BRD4MEN1KMT2A
SCHEMBL7504112 0.67 TRIM24 (0.64) LMNASMN1; SMN2BRD4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110028507-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2011-02-03 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-20110028507-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF EGLN3, EGLN2, HIF1A LMNA 3768/4885SMN1; SMN2 1925/4885BRD4 662/4885

“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.