SCHEMBL20118134

SCHEMBL20118134

CNC(=O)c1ccc2c(c1)sc1c3ccc(C(=O)NC)cc3sc21

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
THRB P10828 1/20 0.47
HDAC8 Q9BY41 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
HDAC2 Q92769 1/20 0.46
PLAU P00749 1/20 0.44
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
CCNC P24863 1/20 0.42
CDK8 P49336 1/20 0.42
PLK1 P53350 6/20 0.42
NCEH1 Q6PIU2 1/20 0.40
CA2 P00918 1/20 0.40
MMP13 P45452 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
SCHEMBL28498281 0.80 PLK1 (0.45) SMN1; SMN2THRBHDAC8HDAC6HDAC2
SCHEMBL10031355 0.79 LIMK1 (0.47) HPGDCA2
SCHEMBL10846058 0.78 MAPT (0.46) SMN1; SMN2THRBHDAC8HDAC6HPGD
SCHEMBL2486863 0.77 KDM4E (0.46) SMN1; SMN2THRBHPGDTSHRCA2
SCHEMBL15024214 0.72 MAPT (0.51) SMN1; SMN2HPGDTSHRCA2
SCHEMBL19929598 0.71 SMN1; SMN2 (0.60) SMN1; SMN2THRBCCNCCDK8PLK1
SCHEMBL8566294 0.71 RAB9A (0.68) SMN1; SMN2HPGDHTT
SCHEMBL250247 0.71 HDAC6 (0.80) SMN1; SMN2HDAC8HDAC6HDAC2PLAU
SCHEMBL13709608 0.70 PLAU (0.61) SMN1; SMN2THRBHDAC8HDAC6HDAC2
SCHEMBL1748004 0.70 SMN1; SMN2 (0.63) SMN1; SMN2THRBPLK1

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-20180122585-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-05-03 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-20180122585-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME SUN2, SLC9A2, SLC43A3 SMN1; SMN2 4582/4885THRB 4698/4885HDAC8 2982/4885

“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.