SCHEMBL25256775

SCHEMBL25256775

CC(C)(C)OC(=O)N[C@@H](CN)C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HTT P42858 1/20 0.47
CTSK P43235 11/20 0.46
CTSS P25774 8/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CTSL P07711 3/20 0.44
CTSB P07858 2/20 0.44
CYP2D6 P10635 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL2393366 1.00 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19HTTCTSK
SCHEMBL20783244 1.00 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19HTTCTSK
Hydrochloric Acid SCHEMBL17686459 0.98 CYP1A2 (0.46) CYP1A2CYP2C9CYP2C19HTTCTSK
Hydrochloric Acid SCHEMBL14471495 0.98 CYP1A2 (0.46) CYP1A2CYP2C9CYP2C19HTTCTSK
SCHEMBL1167043 0.91 CYP1A2 (0.46) CYP1A2CYP2C9CYP2C19HTTCTSK
SCHEMBL1770995 0.91 CYP1A2 (0.46) CYP1A2CYP2C9CYP2C19HTTCTSK
SCHEMBL8238351 0.91 CYP1A2 (0.46) CYP1A2CYP2C9CYP2C19HTTCTSK
Hydrochloric Acid SCHEMBL1770994 0.89 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19HTTCTSK
Hydrochloric Acid SCHEMBL1770997 0.89 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19HTTCTSK
SCHEMBL7494252 0.88 CYP1A2 (0.61) CYP1A2CYP2C9CYP2C19HTTCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346578-A1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS AVEDRO INC (US) 2025-11-13 US disclosed
US-20250283066-A1 METHODS AND COMPOSITIONS UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2025-09-11 US disclosed
US-12344598-B2 Bis(diazirine) derivatives as photo-crosslinker for treating corneal ectatic disorders AVEDRO, INC. (US) 2025-07-01 US disclosed
US-12286657-B2 Methods and compositions UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2025-04-29 US disclosed
US-20250084074-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS MERCK PATENT GMBH (DE) 2025-03-13 US disclosed
EP-4463444-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS Merck Patent GmbH (DE) 2024-11-20 EP disclosed
EP-3914586-B1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS AVEDRO INC (US) 2024-03-27 EP disclosed
WO-2023131690-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS MERCK PATENT GMBH (DE) 2023-07-13 WO disclosed
US-20220106298-A1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS AVEDRO, INC. 2022-04-07 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 (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-20250346578-A1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS SYMPK, DSG1, JUP CYP1A2 964/4885CYP2C9 4096/4885CYP2C19 2260/4885
US-12286657-B2 Methods and compositions TRMT1, TARBP1, RNGTT CYP1A2 4074/4885CYP2C9 3167/4885CYP2C19 4418/4885
US-20250084074-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS VHL, CDKN1A, CCNI CYP1A2 2245/4885CYP2C9 3379/4885CYP2C19 1767/4885
US-20250283066-A1 METHODS AND COMPOSITIONS TRMT1, TARBP1, RNGTT CYP1A2 4074/4885CYP2C9 3167/4885CYP2C19 4418/4885
US-20220106298-A1 BIS(DIAZIRINE) DERIVATIVES AS PHOTO-CROSSSLINKER FOR TREATING CORNEAL ECTATIC DISORDERS PSEN1, DSG1, GRIK1 CYP1A2 1347/4885CYP2C9 4173/4885CYP2C19 2729/4885
US-12344598-B2 Bis(diazirine) derivatives as photo-crosslinker for treating corneal ectatic disorders PSEN1, GRIK1, DSG1 CYP1A2 1368/4885CYP2C9 4164/4885CYP2C19 2608/4885

“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.