SCHEMBL1643985

SCHEMBL1643985

C=C(c1cccc(-c2ccccc2)c1OC)c1cccc(-c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.47
MGAM O43451 4/20 0.47
GAA P10253 4/20 0.47
SI P14410 4/20 0.47
MGAM2 Q2M2H8 4/20 0.47
SCN9A Q15858 1/20 0.42
PTGER1 P34995 2/20 0.41
MAOB P27338 1/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
BCHE P06276 1/20 0.39
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39

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
SCHEMBL1639353 0.91 SCN9A (0.47) MGAMGAASIMGAM2SCN9A
SCHEMBL12726014 0.89 PTGER1 (0.43) NR1H4MGAMGAASIMGAM2
SCHEMBL1644133 0.89 NR1H4 (0.42) NR1H4MGAMGAASIMGAM2
SCHEMBL1642763 0.88 NR1H4 (0.52) NR1H4MGAMGAASIMGAM2
SCHEMBL27864148 0.85 MAOB (0.49) MGAMGAASIMGAM2PTGER1
SCHEMBL1637711 0.84 PTGER1 (0.48) MGAMGAASIMGAM2SCN9A
SCHEMBL12676024 0.82 NR1H4 (0.44) NR1H4GAAKDM4EL3MBTL1HTT
SCHEMBL1637564 0.82 ADORA3 (0.44) PTGER1KDM4EL3MBTL1LMNAHPGD
SCHEMBL8409192 0.81 LMNA (0.55) NR1H4GAASCN9APTGER1KDM4E
SCHEMBL1639034 0.80 MAOB (0.50) NR1H4SCN9APTGER1MAOBL3MBTL1

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
US-8557936-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-10-15 US disclosed
US-8557936-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-10-15 US disclosed
CN-102753584-A Catalyst compounds and use thereof EXXONMOBIL CHEM PATENTS INC 2012-10-24 CN disclosed
CN-102666597-A Catalyst compounds and use thereof EXXONMOBIL CHEM PATENTS INC 2012-09-12 CN disclosed
EP-2493934-A2 CATALYST COMPOUNDS AND USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2012-09-05 EP disclosed
WO-2011056428-A2 CATALYST COMPOUNDS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-05-12 WO disclosed
US-20110098425-A1 Catalyst Compounds and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-04-28 US disclosed
US-20110098425-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-20110098425-A1 Catalyst Compounds and Use Thereof ALOX12, THEM6, ALOX15 NR1H4 2441/4885MGAM 536/4885GAA 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.