SCHEMBL1637564

SCHEMBL1637564

C=C(c1ccccn1)c1cccc(-c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.44
SGMS2 Q8NHU3 1/20 0.38
LMNA P02545 3/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HPGD P15428 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
PTGER1 P34995 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
MITF O75030 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
SCHEMBL12725979 0.85 ADORA3 (0.50) ADORA3SGMS2LMNAHTTSMN1; SMN2
SCHEMBL12646990 0.83 KDM4E (0.42) ADORA3LMNAHTTSMN1; SMN2CHRNB2
SCHEMBL1643985 0.82 NR1H4 (0.47) LMNAHTTHPGDRXRARXRB
SCHEMBL12726014 0.80 PTGER1 (0.43) LMNAHPGDRXRARXRBRXRG
SCHEMBL1636903 0.79 GRM5 (0.40) SGMS2HTTPTGER1L3MBTL1KDM4E
SCHEMBL1639353 0.79 SCN9A (0.47) RXRARXRBRXRGPTGER1L3MBTL1
SCHEMBL1637994 0.76 PTGER1 (0.40) HPGDRXRARXRBRXRGPTGER1
SCHEMBL8797209 0.76 PTGER1 (0.55) CHRNB2CHRNB4CHRNA3CHRNA4RXRA
SCHEMBL1315389 0.75 PTGER1 (0.49) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL27864148 0.74 MAOB (0.49) LMNAHTTSMN1; SMN2PTGER1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541521-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-24 US disclosed
US-8541521-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-24 US disclosed
EP-2493933-A2 CATALYST COMPOUNDS AND USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2012-09-05 EP disclosed
CN-102597015-A Catalyst compounds and use thereof EXXONMOBIL CHEM PATENTS INC 2012-07-18 CN disclosed
WO-2011056424-A2 CATALYST COMPOUNDS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-05-12 WO disclosed
US-20110098427-A1 Catalyst Compounds And Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-04-28 US disclosed
US-20110098427-A1 Catalyst Compounds And Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-04-28 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 (1 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-20110098427-A1 Catalyst Compounds And Use Thereof THEM6, OPRM1, NOTUM ADORA3 2402/4885SGMS2 808/4885LMNA 4064/4885

“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.