SCHEMBL1784418

SCHEMBL1784418

O=Cc1ccc2c(=O)c3ccccc3oc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.62
KDM4E B2RXH2 2/20 0.62
MAPT P10636 2/20 0.62
ALDH1A1 P00352 1/20 0.62
GLA P06280 1/20 0.62
CYP3A4 P08684 1/20 0.62
HPGD P15428 1/20 0.62
PGAM1 P18669 1/20 0.62
CASP1 P29466 1/20 0.62
CASP7 P55210 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
HSD17B10 Q99714 1/20 0.62
NPC1 O15118 6/20 0.55
RAB9A P51151 6/20 0.55
TTR P02766 2/20 0.55
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
L3MBTL1 Q9Y468 3/20 0.50
THRB P10828 1/20 0.50
ADRB2 P07550 1/20 0.48

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
SCHEMBL2533931 0.91 MAPT (0.54) MAOAKDM4EMAPTALDH1A1GLA
SCHEMBL1784133 0.90 MAOA (0.62) MAOAKDM4EMAPTALDH1A1GLA
SCHEMBL24241564 0.82 MAOA (0.56) MAOAKDM4EMAPTALDH1A1GLA
SCHEMBL30367521 0.81 CYP2A6 (0.45) KDM4EMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL6856438 0.81 CYP2A6 (0.45) KDM4EMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL1420897 0.80 MAPT (0.53) MAOAKDM4EMAPTALDH1A1GLA
SCHEMBL28257333 0.80 MAOA (0.69) MAOAKDM4EMAPTALDH1A1GLA
SCHEMBL28259686 0.80 MAOA (0.53) MAOAKDM4EMAPTALDH1A1GLA
SCHEMBL28257336 0.80 MAOA (0.69) MAOAKDM4EMAPTALDH1A1GLA
SCHEMBL28259688 0.80 MAOA (0.53) MAOAKDM4EMAPTALDH1A1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8323750-B2 Method of ultraviolet light assisted surface modification and product having a surface formed by this method BEIJING WANHEXINYUAN BIOTECHNOLOGY CO., LTD. (CN) 2012-12-04 US disclosed
US-20110124766-A1 METHOD OF ULTRAVIOLET LIGHT ASSISTED SURFACE MODIFICATION AN PRODUCT HAVING A SURFACE FORMED BY THIS METHOD BEIJING WANHEXINYUAN BIOTECHNOLOGY CO., LTD. (CN) 2011-05-26 US disclosed
US-20090291979-A1 TRICYCLIC-BRIDGED PIPERIDINYLIDENE DERIVATIVES AS DELTA OPIOID MODULATORS DAX SCOTT 2009-11-26 US disclosed
CN-101039940-A Tricyclic delta-opioid modulators JANSSEN PHARMACEUTICA NV (BE) 2007-09-19 CN 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-20090291979-A1 TRICYCLIC-BRIDGED PIPERIDINYLIDENE DERIVATIVES AS DELTA OPIOID MODULATORS OPRD1, OPRK1, OPRM1 MAOA 1245/4885KDM4E 1763/4885MAPT 1930/4885
US-20110124766-A1 METHOD OF ULTRAVIOLET LIGHT ASSISTED SURFACE MODIFICATION AN PRODUCT HAVING A SURFACE FORMED BY THIS METHOD XPA, CYBA, PROC MAOA 34/4885KDM4E 1160/4885MAPT 1624/4885

“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.