SCHEMBL20901302

SCHEMBL20901302

CC(C)(C)[Si](C)(C)N1C(=O)[C@H](CC=N)[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.41
FKBP1A P62942 2/20 0.39
ELANE P08246 5/20 0.36
CTSL P07711 1/20 0.36
KLK3 P07288 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL13302626 0.89 ELANE (0.46) FOLH1FKBP1AELANE
SCHEMBL16989188 0.88 FOLH1 (0.40) FOLH1FKBP1AELANECTSLKLK3
SCHEMBL16998961 0.88 FOLH1 (0.40) FOLH1FKBP1AELANECTSLKLK3
SCHEMBL7427227 0.84 FOLH1 (0.43) FOLH1FKBP1AELANECTSLKLK3
SCHEMBL16989180 0.82 FOLH1 (0.39) FOLH1FKBP1AELANECTSLKLK3
SCHEMBL16989257 0.82 FOLH1 (0.38) FOLH1FKBP1AELANE
SCHEMBL7426204 0.81 FKBP1A (0.44) FOLH1FKBP1AELANECTSL
SCHEMBL16989152 0.81 FOLH1 (0.39) FOLH1FKBP1AELANECTSLKLK3
SCHEMBL13302719 0.81 FOLH1 (0.42) FOLH1FKBP1AELANECTSLALDH1A1
SCHEMBL16989235 0.80 FOLH1 (0.37) FOLH1FKBP1AELANECTSLHPGD

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-11198673-B2 Therapeutic compounds and compositions EXITHERA PHARMACEUTICALS, INC. (US) 2021-12-14 US disclosed
US-10259785-B2 Therapeutic compounds and compositions EXITHERA PHARMACEUTICALS, INC. (US) 2019-04-16 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 (2 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-11198673-B2 Therapeutic compounds and compositions KLK5, KLKB1, KLK2 FOLH1 1124/4885FKBP1A 2210/4885ELANE 57/4885
US-10259785-B2 Therapeutic compounds and compositions KLK5, KLKB1, KLK2 FOLH1 1124/4885FKBP1A 2210/4885ELANE 57/4885

“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.