SCHEMBL3552438

SCHEMBL3552438

CCOC(=O)C1(C(=O)Cl)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
OPRM1 P35372 7/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ATM Q13315 1/20 0.36
OPRD1 P41143 3/20 0.36
OPRK1 P41145 3/20 0.36
ALOX15 P16050 1/20 0.36
SLC22A1 O15245 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
KCNH2 Q12809 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36

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
SCHEMBL9416724 0.92 MEN1 (0.40) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL3553535 0.92 MEN1 (0.43) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL11725215 0.90 MEN1 (0.39) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL69496 0.86 ALDH1A1 (0.46) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL18134201 0.86 ALDH1A1 (0.46) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL17230366 0.81 MEN1 (0.37) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL373936 0.80 ALDH1A1 (0.44) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL374081 0.80 OPRM1 (0.41) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL9065399 0.78 ALOX15 (0.46) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL15797775 0.78 ALDH1A1 (0.39) ALDH1A1MEN1KMT2APOLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11008312-B2 Pyridazine derivatives as RORc modulators GENENTECH, INC. (US) 2021-05-18 US disclosed
US-11008312-B2 Pyridazine derivatives as RORc modulators GENENTECH, INC. (US) 2021-05-18 US disclosed
EP-3535255-A1 PYRIDAZINE DERIVATIVES AS RORC MODULATORS H. Hoffnabb-La Roche Ag (CH) 2019-09-11 EP disclosed
US-20190263794-A1 PYRIDAZINE DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2019-08-29 US disclosed
US-20190263794-A1 PYRIDAZINE DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2019-08-29 US disclosed
EP-1889836-B1 NOVEL PYRIDINE DERIVATIVE AND PYRIMIDINE DERIVATIVE (3) EISAI R&D MAN CO LTD (JP) 2013-06-12 EP disclosed
US-8288538-B2 Pyridine derivatives and pyrimidine derivatives (3) EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-10-16 US disclosed
US-20120232049-A1 PYRIDINE OR PYRIMIDINE DERIVATIVE HAVING EXCELLENT CELL GROWTH INHIBITION EFFECT AND EXCELLENT ANTI-TUMOR EFFECT ON CELL STRAIN HAVING AMPLIFICATION OF HGFR GENE EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-13 US disclosed
US-7855290-B2 N-[4-({2-[({4-[2-(Dimethylamino)ethyl]piperazin-1-yl}carbonyl)amino]pyridin-4-yl}oxy)-2-fluorophenyl]-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide; hepatocyte growth factor receptor (HGFR) inhibitors; antitumor, -carcinogenic, -metastasis agents EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-21 US disclosed
US-20100075944-A1 NOVEL PYRIDINE DERIVATIVES AND PYRIMIDINE DERIVATIVES (3) MATSUSHIMA TOMOHIRO 2010-03-25 US disclosed
US-5292937-A Use of malonic acid derivative compounds for retarding plant growth RHONE-POULENC INC. (US) 1994-03-08 US disclosed
EP-0269656-B1 NOVEL MALONIC ACID DERIVATIVE COMPOUNDS AND COMPOSITIONS THEREOF FOR RETARDING PLANT GROWTH RHONE POULENC BV (NL) 1993-12-29 EP disclosed
EP-0262209-B1 SYNERGISTIC PLANT GROWTH REGULATOR COMPOSITIONS RHONE POULENC BV (NL) 1992-08-05 EP disclosed
US-5123951-A Ethylene response inducing agent and malonic acid derivative RHONE-POULENC NEDERLAND B.V. (NL) 1992-06-23 US disclosed
US-4876279-A Antihypercholesterolemic compounds MERCK & CO., INC. (US) 1989-10-24 US disclosed
US-4766145-A Antihypercholesterolemic compounds MERCK & CO., INC. (US) 1988-08-23 US disclosed
EP-0262209-A1 SYNERGISTIC PLANT GROWTH REGULATOR COMPOSITIONS. RHONE POULENC BV (NL) 1988-04-06 EP disclosed
CN-87103565-A SYNERGISTIC PLANT GROWTH REGULATOR COMPOSITIONS 1988-03-02 CN disclosed
EP-0245004-A2 Antihypercholesterolemic compounds MERCK & CO. INC. (US) 1987-11-11 EP disclosed
WO-1987005781-A2 SYNERGISTIC PLANT GROWTH REGULATOR COMPOSITIONS RHONE-POULENC NEDERLANDS B.V. (NL) 1987-10-08 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 (4 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-11008312-B2 Pyridazine derivatives as RORc modulators RORC, RORB, RORA ALDH1A1 897/4885MEN1 2592/4885KMT2A 2265/4885
US-20120232049-A1 PYRIDINE OR PYRIMIDINE DERIVATIVE HAVING EXCELLENT CELL GROWTH INHIBITION EFFECT AND EXCELLENT ANTI-TUMOR EFFECT ON CELL STRAIN HAVING AMPLIFICATION OF HGFR GENE HGF, MET, MKI67 ALDH1A1 724/4885MEN1 2263/4885KMT2A 3405/4885
US-20100075944-A1 NOVEL PYRIDINE DERIVATIVES AND PYRIMIDINE DERIVATIVES (3) HGF, MET, HDGF ALDH1A1 887/4885MEN1 3868/4885KMT2A 4123/4885
US-20190263794-A1 PYRIDAZINE DERIVATIVES AS RORc MODULATORS RORC, RORB, RORA ALDH1A1 897/4885MEN1 2592/4885KMT2A 2265/4885

“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.