SCHEMBL16989264

SCHEMBL16989264

COc1cc(OC)c(CNC(=O)[C@H]2NC(=O)[C@@H]2Cc2ccnc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c2)c(OC)c1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.36
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SYK P43405 1/20 0.31
P2RX7 Q99572 1/20 0.30

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
SCHEMBL18476744 1.00 PTPN1 (0.36) PTPN1ALDH1A1MEN1KMT2ASYK
SCHEMBL18470440 0.92 SYK (0.34) SYK
SCHEMBL16998966 0.92 SYK (0.34) SYK
SCHEMBL18237197 0.89 PTPN1 (0.41) PTPN1ALDH1A1MEN1KMT2AP2RX7
SCHEMBL27047943 0.86 PTPN1 (0.36) PTPN1ALDH1A1KMT2ASYKP2RX7
SCHEMBL16989068 0.82 PTPN1 (0.34) PTPN1ALDH1A1MEN1KMT2AP2RX7
SCHEMBL20244143 0.82 PTPN1 (0.34) PTPN1ALDH1A1MEN1KMT2AP2RX7
SCHEMBL13302748 0.82 SYK (0.36) SYK
SCHEMBL3335928 0.82 SYK (0.36) SYK
SCHEMBL3338219 0.80 SYK (0.35) SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250214931-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS Cadrenal Therapeutics, Inc. 2025-07-03 US disclosed
US-12084414-B2 Therapeutic compounds and compositions EXITHERA PHARMACEUTICALS, INC. (US) 2024-09-10 US disclosed
EP-4309653-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS Exithera Pharmaceuticals Inc. (US) 2024-01-24 EP disclosed
EP-4309653-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS Exithera Pharmaceuticals Inc. (US) 2024-01-24 EP disclosed
EP-3102200-B1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS EXITHERA PHARMACEUTICALS INC (US) 2023-04-05 EP disclosed
US-20220281813-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS EXITHERA PHARMACEUTICALS, INC. 2022-09-08 US disclosed
US-10259785-B2 Therapeutic compounds and compositions EXITHERA PHARMACEUTICALS, INC. (US) 2019-04-16 US disclosed
US-20170037003-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS Cadrenal Therapeutics, Inc. 2017-02-09 US disclosed
US-9499532-B2 Therapeutic compounds and compositions eXIthera Pharmaceuticals Inc. (US) 2016-11-22 US disclosed
US-20150225389-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS eXIthera Pharmaceuticals Inc. (US) 2015-08-13 US disclosed
US-20150225389-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS eXIthera Pharmaceuticals Inc. (US) 2015-08-13 US disclosed
WO-2015120062-A2 THERAPEUTIC COMPOUNDS AND COMPOSITIONS eXIthera Pharmaceuticals Inc. (US) 2015-08-13 WO 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 (6 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-20170037003-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS KLK5, KLKB1, KLK2 PTPN1 4272/4885ALDH1A1 4490/4885MEN1 261/4885
US-12084414-B2 Therapeutic compounds and compositions KLK5, KLKB1, KLK2 PTPN1 4272/4885ALDH1A1 4490/4885MEN1 261/4885
US-20220281813-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS KLK5, KLKB1, KLK2 PTPN1 4272/4885ALDH1A1 4490/4885MEN1 261/4885
US-10259785-B2 Therapeutic compounds and compositions KLK5, KLKB1, KLK2 PTPN1 4272/4885ALDH1A1 4490/4885MEN1 261/4885
US-20150225389-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS KLK5, KLKB1, KLK2 PTPN1 4272/4885ALDH1A1 4490/4885MEN1 261/4885
US-20250214931-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS KLK5, KLKB1, KLK2 PTPN1 4272/4885ALDH1A1 4490/4885MEN1 261/4885

“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.