SCHEMBL4139738

SCHEMBL4139738

CSc1cccc(-n2c(C(F)(F)F)nc3sc4c(c3c2=O)CCCCC4)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
LMNA P02545 3/20 0.51
ALDH1A1 P00352 4/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
NPSR1 Q6W5P4 2/20 0.49
RECQL P46063 1/20 0.48
KDM4E B2RXH2 2/20 0.48
GAA P10253 2/20 0.48
TGM2 P21980 1/20 0.47
TP53 P04637 2/20 0.45
POLB P06746 3/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CDKN1A P38936 1/20 0.43

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
SCHEMBL4144896 0.88 ALDH1A1 (0.53) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4132548 0.88 ALDH1A1 (0.53) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4156752 0.87 ALDH1A1 (0.53) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4141378 0.86 MAPT (0.51) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4139711 0.86 MAPT (0.51) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4147430 0.86 MAPT (0.51) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4154510 0.86 BRD4 (0.52) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4137069 0.86 LMNA (0.58) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4134647 0.85 MAPT (0.52) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL4153731 0.85 MAPT (0.52) MAPTLMNAALDH1A1MEN1KMT2A

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-20090143411-A1 Thiophens and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2009-06-04 US claimed
US-20090143411-A1 Thiophens and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2009-06-04 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-20090143411-A1 Thiophens and Their Use as Anti-Tumor Agents TP53, BRDT, VHL MAPT 1629/4885LMNA 3634/4885ALDH1A1 1202/4885

“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.