SCHEMBL1826604

SCHEMBL1826604

CC(C)OC(=O)C(CN)C(Cc1ccccc1)c1ccc(OS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ADAMTS4 O75173 1/20 0.39
ENPP3 O14638 2/20 0.39
ENPP1 P22413 2/20 0.39
ENPP2 Q13822 1/20 0.38
P2RX7 Q99572 4/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
EGFR P00533 1/20 0.37
CNR1 P21554 1/20 0.37
KDM4E B2RXH2 1/20 0.36
KDM4A O75164 1/20 0.36
STS P08842 1/20 0.36
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL1824217 0.94 P2RX7 (0.45) MEN1KMT2AENPP3ENPP1ENPP2
SCHEMBL3578134 0.89 PPARG (0.40) MEN1KMT2ACNR1STSTSHR
SCHEMBL1826144 0.89 MEN1 (0.49) MEN1KMT2AADAMTS4ENPP3ENPP1
SCHEMBL1825046 0.88 P2RX7 (0.40) MEN1KMT2AADAMTS4ENPP3ENPP1
SCHEMBL1824311 0.87 P2RX7 (0.43) ENPP3ENPP1P2RX7TDP1
SCHEMBL1825657 0.87 P2RX7 (0.43) MEN1KMT2AADAMTS4P2RX7TDP1
SCHEMBL1824541 0.84 CA1 (0.39) ADAMTS4ENPP3ENPP1P2RX7TDP1
SCHEMBL1826820 0.84 TSHR (0.39) MEN1KMT2AADAMTS4ENPP3ENPP1
SCHEMBL1826383 0.84 P2RX7 (0.48) MEN1KMT2AENPP3ENPP1ENPP2
SCHEMBL1828168 0.84 P2RX7 (0.46) MEN1KMT2AENPP1ENPP2P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2161254-B1 Intermediate for preparing a biaryl compound SUMITOMO CHEMICAL CO (JP) 2014-08-13 EP disclosed
EP-1481967-B1 PROCESS FOR THE PREPARATION OF BIARYL COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2011-05-04 EP disclosed
US-7714157-B2 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-11 US disclosed
EP-2161254-A1 Intermediate for preparing a biaryl compound Sumitomo Chemical Company, Limited (JP) 2010-03-10 EP disclosed
US-20070270603-A1 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED 2007-11-22 US disclosed
US-7271280-B2 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-09-18 US disclosed
EP-1481967-A1 PROCESS FOR THE PREPARATION OF BIARYL COMPOUNDS Sumitomo Chemical Company, Limited (JP) 2004-12-01 EP disclosed
US-20040158093-A1 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED 2004-08-12 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 (2 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-20040158093-A1 Process for preparing a biaryl compound CYP1B1, REL, CYP2F1 MEN1 421/4885KMT2A 1068/4885ADAMTS4 4799/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 MEN1 183/4885KMT2A 1084/4885ADAMTS4 4532/4885

“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.