SCHEMBL4151102

SCHEMBL4151102

O=c1c2c3c(sc2nc(C(F)(F)F)n1-c1ccc(C(F)(F)F)nc1)CCCCC3

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
LMNA P02545 6/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 6/20 0.46
GAA P10253 2/20 0.46
KDM4E B2RXH2 2/20 0.46
POLB P06746 3/20 0.45
SMN1; SMN2 Q16637 6/20 0.45
HPGD P15428 3/20 0.44
TSHR P16473 1/20 0.44
TP53 P04637 2/20 0.44
NPSR1 Q6W5P4 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALOX15 P16050 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
SCHEMBL4132514 0.85 ALDH1A1 (0.60) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4144919 0.85 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4144374 0.84 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4138842 0.84 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4146568 0.84 MAPT (0.64) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4154511 0.84 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4154513 0.84 MAPT (0.51) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4141371 0.83 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4151128 0.83 MAPT (0.52) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4144240 0.83 MAPT (0.62) ALDH1A1LMNAMEN1KMT2AMAPT

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 ALDH1A1 1202/4885LMNA 3634/4885MEN1 46/4885

“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.