SCHEMBL19011981

SCHEMBL19011981

CCC(CC)COC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.48

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
SCHEMBL19011834 0.85 MAPK1 (0.41) MAPK1
SCHEMBL20102819 0.85 MAPK1 (0.41) MAPK1
SCHEMBL12555905 0.85 MAPK1 (0.46) MAPK1
SCHEMBL13034048 0.84 MAPK1 (0.55) MAPK1
SCHEMBL11927544 0.79 CYP3A4 (0.46) MAPK1
SCHEMBL28186037 0.78 CYP3A4 (0.38) MAPK1
SCHEMBL14213288 0.78 MAPK1 (0.40) MAPK1
SCHEMBL13073321 0.76 MAPK1 (0.42) MAPK1
SCHEMBL12285564 0.74 MAPK1 (0.52) MAPK1
SCHEMBL17471306 0.74 MAPK1 (0.52) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365563-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2023-11-16 US disclosed
US-11168101-B2 Crystal of cyclic phosphonic acid sodium salt and method for manufacturing same OTSUKA CHEMICAL CO., LTD. (JP) 2021-11-09 US disclosed
WO-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed
US-10774100-B2 Crystal of cyclic phosphonic acid sodium salt and method for manufacturing same OTSUKA CHECMIAL CO., LTD. (JP) 2020-09-15 US disclosed
US-20200277317-A1 CRYSTAL OF CYCLIC PHOSPHONIC ACID SODIUM SALT AND METHOD FOR MANUFACTURING SAME OTSUKA CHEMICAL CO., LTD. (JP) 2020-09-03 US disclosed
EP-3181573-B1 CRYSTAL OF CYCLIC PHOSPHONIC ACID SODIUM SALT AND METHOD FOR MANUFACTURING SAME OTSUKA CHEMICAL CO LTD (JP) 2020-06-17 EP disclosed
US-20190330251-A1 CRYSTAL OF CYCLIC PHOSPHONIC ACID SODIUM SALT AND METHOD FOR MANUFACTURING SAME OTSUKA CHEMICAL CO., LTD. (JP) 2019-10-31 US disclosed
US-10385081-B2 Crystal of cyclic phosphonic acid sodium salt and method for manufacturing same OTSUKA CHEMICAL CO., LTD. (JP) 2019-08-20 US disclosed
US-20180208614-A1 CRYSTAL OF CYCLIC PHOSPHONIC ACID SODIUM SALT AND METHOD FOR MANUFACTURING SAME OTSUKA CHEMICAL CO., LTD. (JP) 2018-07-26 US disclosed
EP-3181573-A1 CRYSTAL OF CYCLIC PHOSPHONIC ACID SODIUM SALT AND METHOD FOR MANUFACTURING SAME Otsuka Chemical Co., Ltd. (JP) 2017-06-21 EP 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 (7 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-11168101-B2 Crystal of cyclic phosphonic acid sodium salt and method for manufacturing same PPM1A, PPP1CA, PPM1G MAPK1 449/4885
US-10774100-B2 Crystal of cyclic phosphonic acid sodium salt and method for manufacturing same PPM1A, PPM1G, PPP1CA MAPK1 329/4885
US-20180208614-A1 CRYSTAL OF CYCLIC PHOSPHONIC ACID SODIUM SALT AND METHOD FOR MANUFACTURING SAME PPM1A, PPP1CA, PPM1G MAPK1 403/4885
US-20200277317-A1 CRYSTAL OF CYCLIC PHOSPHONIC ACID SODIUM SALT AND METHOD FOR MANUFACTURING SAME PPM1A, PPP1CA, PPM1G MAPK1 449/4885
US-20230365563-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF KRAS, NRAS, BRAF MAPK1 81/4885
US-20190330251-A1 CRYSTAL OF CYCLIC PHOSPHONIC ACID SODIUM SALT AND METHOD FOR MANUFACTURING SAME PPM1A, PPM1G, PPP1CA MAPK1 329/4885
US-10385081-B2 Crystal of cyclic phosphonic acid sodium salt and method for manufacturing same PPM1A, PPP1CA, PPM1G MAPK1 403/4885

“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.