SCHEMBL18044481

SCHEMBL18044481

COc1ccc(OCc2ccccc2)cc1F

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.58
FFAR1 O14842 8/20 0.54
PPARD Q03181 5/20 0.54
ALOX5 P09917 1/20 0.53
LMNA P02545 3/20 0.51
ALDH1A1 P00352 2/20 0.51
MAPT P10636 1/20 0.51
ALOX12 P18054 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PDGFRB P09619 1/20 0.50
PDGFRA P16234 1/20 0.50
HTT P42858 2/20 0.49
HPGD P15428 1/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL27882779 0.87 MAOB (0.58) MAOBFFAR1PPARD
SCHEMBL15365 0.87 MAOB (0.58) MAOBFFAR1ALOX5LMNAALDH1A1
SCHEMBL18623122 0.83 MAOB (0.62) MAOBALOX5LMNAALDH1A1MAPT
SCHEMBL2090976 0.83 MAOB (0.62) MAOBALOX5LMNAALDH1A1MAPT
SCHEMBL20252664 0.83 MAOB (0.57) MAOBFFAR1PPARDALOX5ALDH1A1
SCHEMBL1128493 0.83 FFAR1 (0.59) FFAR1PPARDALOX5
SCHEMBL8184228 0.82 MAOB (0.60) MAOBALOX5LMNAALDH1A1MAPT
SCHEMBL30148511 0.82 MAOB (0.60) MAOBALOX5LMNAALDH1A1MAPT
SCHEMBL13802180 0.82 MAOB (0.60) MAOBFFAR1PPARDALOX5LMNA
SCHEMBL15817 0.81 ALOX5 (0.61) MAOBALOX5LMNAMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3067351-B1 COMPOUND HAVING HIGHER INHIBITION OF PROTEIN KINASE G ACTIVITY AND PREPARATION METHOD THEREFOR JENKEM TECH CO LTD TIANJIN (CN) 2019-02-06 EP disclosed
US-9925171-B2 Compound having higher inhibitory activity on protein kinase G and preparation method thereof Jenkem Technology Co., Ltd., (Tianjin) (CN) 2018-03-27 US disclosed
US-20170119736-A1 COMPOUND HAVING HIGHER INHIBITORY ACTIVITY ON PROTEIN KINASE G AND PREPARATION METHOD THEREOF Jenkem Technology Co., Ltd., (Tianjin) (CN) 2017-05-04 US disclosed
US-9567319-B2 Compound having higher inhibitory activity on protein kinase G and preparation method thereof JENKEM TECHNOLOGY CO. LTD., (TIANJIN) (CN) 2017-02-14 US disclosed
US-20160304501-A1 COMPOUND HAVING HIGHER INHIBITORY ACTIVITY ON PROTEIN KINASE G AND PREPARATION METHOD THEREOF Jenkem Technology Co., Ltd., (Tianjin) (CN) 2016-10-20 US disclosed
EP-3067351-A1 COMPOUND HAVING HIGHER INHIBITION OF PROTEIN KINASE G ACTIVITY AND PREPARATION METHOD THEREFOR Jenkem Technology Co. Ltd. (Tianjin) (CN) 2016-09-14 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 (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-20160304501-A1 COMPOUND HAVING HIGHER INHIBITORY ACTIVITY ON PROTEIN KINASE G AND PREPARATION METHOD THEREOF PRKCG, PRKG2, PKN3 MAOB 1897/4885FFAR1 1354/4885PPARD 3438/4885
US-20170119736-A1 COMPOUND HAVING HIGHER INHIBITORY ACTIVITY ON PROTEIN KINASE G AND PREPARATION METHOD THEREOF PRKCG, PRKG2, PKN3 MAOB 1897/4885FFAR1 1354/4885PPARD 3438/4885

“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.