SCHEMBL27415414

SCHEMBL27415414

C[C@H]1CCc2sc(NC(=O)C3CC3(F)F)cc2C1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
NPC1 O15118 7/20 0.46
RAB9A P51151 6/20 0.46
MAPT P10636 7/20 0.44
LMNA P02545 4/20 0.44
KDM4E B2RXH2 1/20 0.44
KMT2A Q03164 4/20 0.41
MEN1 O00255 1/20 0.41
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
ALOX12 P18054 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
SCHEMBL21603764 0.83 ALDH1A1 (0.54) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL21604124 0.81 ALDH1A1 (0.42) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL27415416 0.80 NPC1 (0.32) ALDH1A1NPC1RAB9A
SCHEMBL27415413 0.80 EPHX2 (0.36) NPC1RAB9AKMT2A
SCHEMBL21597427 0.68 TBXAS1 (0.46) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL21597801 0.68 TP53 (0.40) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL3348661 0.67 ALDH1A1 (0.69) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL21597674 0.66 TP53 (0.44) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL21603763 0.65 TP53 (0.39) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL21597854 0.65 TP53 (0.41) ALDH1A1NPC1RAB9ALMNAKMT2A

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-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE UCB Biopharma SRL (BE) 2024-06-25 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-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE TSLP, CYSLTR1, CYSLTR2 ALDH1A1 233/4885NPC1 185/4885RAB9A 2032/4885

“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.