SCHEMBL13637458

SCHEMBL13637458

Cc1cccc(CNS(=O)(=O)c2cccc(CCNCl)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.60
CYP19A1 P11511 4/20 0.58
AKR1C3 P42330 2/20 0.58
MAPT P10636 1/20 0.57
KMT2A Q03164 3/20 0.55
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C19 P33261 1/20 0.49
CA12 O43570 1/20 0.49
ATM Q13315 1/20 0.49
CA9 Q16790 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
FBP1 P09467 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL13637468 0.81 CYP19A1 (0.64) ALDH1A1CYP19A1AKR1C3MAPTKMT2A
SCHEMBL14049770 0.81 AKR1C3 (0.52) ALDH1A1CYP19A1AKR1C3MAPTLMNA
SCHEMBL4661682 0.81 CYP19A1 (0.71) ALDH1A1CYP19A1MAPTKMT2ALMNA
SCHEMBL14751071 0.78 ALDH1A1 (0.71) ALDH1A1CYP19A1AKR1C3MAPTKMT2A
SCHEMBL30822628 0.78 ALDH1A1 (0.71) ALDH1A1CYP19A1AKR1C3MAPTKMT2A
SCHEMBL13637461 0.78 CYP19A1 (0.59) ALDH1A1CYP19A1AKR1C3MAPTKMT2A
SCHEMBL16660687 0.78 ALDH1A1 (0.73) ALDH1A1CYP19A1KMT2ALMNACYP1A2
SCHEMBL18088404 0.75 ALDH1A1 (1.00) ALDH1A1AKR1C3KMT2AKDM4EMEN1
SCHEMBL12530468 0.75 KMT2A (0.59) ALDH1A1CYP19A1KMT2ALMNAMEN1
SCHEMBL14902026 0.74 KMT2A (0.62) ALDH1A1CYP19A1MAPTKMT2ALMNA

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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2009-11-05 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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MAVS, ZC3HAV1, EIF2AK2 ALDH1A1 2676/4885CYP19A1 3957/4885AKR1C3 3557/4885

“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.