SCHEMBL253353

SCHEMBL253353

C=CCNc1ccccc1.[CaH2]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.52
CA2 P00918 2/20 0.52
CA9 Q16790 2/20 0.52
CA1 P00915 1/20 0.52
ALDH1A1 P00352 4/20 0.46
MAPT P10636 2/20 0.46
CYP1A2 P05177 1/20 0.44
TGM2 P21980 1/20 0.43
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
MITF O75030 1/20 0.42
NSD2 O96028 1/20 0.42
LMNA P02545 1/20 0.42
CASP3 P42574 1/20 0.42

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
SCHEMBL16371883 0.98 CA12 (0.53) CA12CA2CA9CA1ALDH1A1
SCHEMBL11051 0.98 CA12 (0.53) CA12CA2CA9CA1ALDH1A1
SCHEMBL28296540 0.95 CA12 (0.52) CA12CA2CA9CA1ALDH1A1
Iodide SCHEMBL11631405 0.95 CA12 (0.52) CA12CA2CA9CA1ALDH1A1
SCHEMBL10385905 0.95 CA12 (0.52) CA12CA2CA9CA1ALDH1A1
Water SCHEMBL10657216 0.95 CA12 (0.52) CA12CA2CA9CA1ALDH1A1
Hydrochloric Acid SCHEMBL728400 0.95 CA12 (0.52) CA12CA2CA9CA1ALDH1A1
Cyanide SCHEMBL29655773 0.91 CA12 (0.48) CA12CA2CA9CA1ALDH1A1
SCHEMBL821094 0.89 ALDH1A1 (0.54) CA12CA2CA9CA1ALDH1A1
SCHEMBL27549272 0.87 CA12 (0.46) CA12CA2CA9CA1ALDH1A1

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 353 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021262825-A2 DISRUPTING LIPID SYNTHESIS: A NOVEL TARGET FOR BROAD-SPECTRUM HOST-DIRECTED ANTI-VIRULENCE THERAPEUTICS GENETIC NETWORKS, LLC (US) 2021-12-30 WO claimed
US-10639308-B2 sGC stimulators CYCLERION THERAPEUTICS, INC. (US) 2020-05-05 US claimed
US-20200087367-A1 COMPOSITIONS AND METHODS FOR TREATING HEART FAILURE ACCELERON PHARMA INC. 2020-03-19 US claimed
CN-110603049-A Compositions and methods for treating heart failure 阿塞勒隆制药公司 2019-12-20 CN claimed
EP-2953558-B1 EMBRYO TRANSFER CATHETER SILLENDER MARK (AU) 2019-08-28 EP claimed
US-10154856-B2 Therapeutic substance transfer catheter and method SILLENDER MARK (AU) 2018-12-18 US claimed
WO-2018144968-A1 COMPOSITIONS AND METHODS FOR TREATING HEART FAILURE ACCELERON PHARMA INC. (US) 2018-08-09 WO claimed
EP-3160464-A1 USE OF BUSPIRONE METABOLITES Contera Pharma APS (DK) 2017-05-03 EP claimed
WO-2015197079-A1 USE OF BUSPIRONE METABOLITES CONTERA PHARMA APS (DK) 2015-12-30 WO claimed
US-20150359566-A1 THERAPEUTIC SUBSTANCE TRANSFER CATHETER AND METHOD SILLENDER MARK (US) 2015-12-17 US claimed
EP-2953678-A1 THERAPEUTIC SUBSTANCE TRANSFER CATHETER AND METHOD Sillender, Mark (AU) 2015-12-16 EP claimed
EP-2953558-A1 EMBRYO TRANSFER CATHETER AND METHOD Sillender, Mark (AU) 2015-12-16 EP claimed
US-20150342642-A1 EMBRYO TRANSFER CATHETER AND METHOD SILLENDER MARK (US) 2015-12-03 US claimed
WO-2015051336-A1 COMPOSITIONS AND METHODS FOR TREATING PELVIC PAIN AND OTHER CONDITIONS WISE DAVID (US) 2015-04-09 WO claimed
WO-2014121332-A1 THERAPEUTIC SUBSTANCE TRANSFER CATHETER AND METHOD SILLENDER MARK (AU) 2014-08-14 WO claimed
WO-2014121333-A1 EMBRYO TRANSFER CATHETER AND METHOD SILLENDER MARK (AU) 2014-08-14 WO claimed
US-20100034884-A1 LUMINESCENT CONDUCTING NANO-DRUG CRYSTAL ULTRA-THIN FILM SELF-ASSEMBLY AND USES ZHONGSHAN HOSPITAL, FUDAN UNIVERSITY (CN) 2010-02-11 US claimed
US-7125559-B2 Cosmetic or dermatological composition comprising a combination of an elastase inhibitor of the N-acylaminoamide family and at least one myorelaxing agent L'OREAL (FR) 2006-10-24 US claimed
US-20240228520-A9 PHOSPHORUS PRODRUGS OF PYRAZOLO-SUBSTITUTED PYRIMIDINE SGC STIMULATORS CYCLERION THERAPEUTICS INC (US) 2024-07-11 US disclosed
WO-1992000729-A1 DOSAGE FORM FOR ADMINISTERING A DRUG TO EFFECT CIRCADIAN THERAPY ALZA CORPORATION (US) 1992-01-23 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 (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-20200087367-A1 COMPOSITIONS AND METHODS FOR TREATING HEART FAILURE BMPR2, BMPR1B, BMP1 CA12 722/4885CA2 1434/4885CA9 424/4885
US-10639308-B2 sGC stimulators PTGIS, CGAS, GUCY1A1 CA12 4513/4885CA2 1774/4885CA9 3467/4885
US-20240228520-A9 PHOSPHORUS PRODRUGS OF PYRAZOLO-SUBSTITUTED PYRIMIDINE SGC STIMULATORS P2RY1, P2RY11, GMPS CA12 4220/4885CA2 1642/4885CA9 3153/4885

“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.