SCHEMBL18300554

SCHEMBL18300554

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1nccc2cc(Cl)c(CBr)cc12

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.35
SYK P43405 1/20 0.35
AAK1 Q2M2I8 14/20 0.34
SSTR4 P31391 1/20 0.33
GRM4 Q14833 1/20 0.31
NR1H4 Q96RI1 1/20 0.31

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
SCHEMBL20357942 0.95 SYK (0.33) PDPK1SYKAAK1SSTR4NR1H4
SCHEMBL18300147 0.89 PDPK1 (0.35) PDPK1SYKAAK1SSTR4GRM4
SCHEMBL18300527 0.88 PDPK1 (0.35) PDPK1SYKAAK1SSTR4GRM4
SCHEMBL18300427 0.84 SYK (0.36) PDPK1SYKAAK1SSTR4NR1H4
SCHEMBL3738636 0.81 SSTR4 (0.37) PDPK1SYKAAK1SSTR4NR1H4
SCHEMBL17981437 0.80 PDPK1 (0.35) PDPK1AAK1SSTR4
SCHEMBL960748 0.80 SSTR4 (0.37) PDPK1SYKAAK1SSTR4
SCHEMBL18300649 0.78 PDPK1 (0.37) PDPK1SYKAAK1SSTR4NR1H4
SCHEMBL18300644 0.77 SSTR4 (0.34) PDPK1SYKAAK1SSTR4
SCHEMBL833581 0.76 PDPK1 (0.32) PDPK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10144746-B2 Bridged bicyclic kallikrein inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2018-12-04 US disclosed
US-20180194780-A1 BRIDGED BICYCLIC KALLIKREIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2018-07-12 US disclosed
US-9815853-B2 Bridged bicyclic kallikrein inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-11-14 US disclosed
WO-2016201052-A1 BRIDGED BICYCLIC KALLIKREIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2016-12-15 WO disclosed
US-20160362427-A1 BRIDGED BICYCLIC KALLIKREIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2016-12-15 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 (3 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-10144746-B2 Bridged bicyclic kallikrein inhibitors KLKB1, KLK1, KLK2 PDPK1 688/4885SYK 3998/4885AAK1 1069/4885
US-20160362427-A1 BRIDGED BICYCLIC KALLIKREIN INHIBITORS KLKB1, KLK1, KLK2 PDPK1 688/4885SYK 3998/4885AAK1 1069/4885
US-20180194780-A1 BRIDGED BICYCLIC KALLIKREIN INHIBITORS KLKB1, KLK1, KLK2 PDPK1 688/4885SYK 3998/4885AAK1 1069/4885

“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.