SCHEMBL19660281

SCHEMBL19660281

O=Cc1cc(OCc2ccccc2)ccc1-c1cccc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.51
MAOB P27338 4/20 0.51
ALOX5 P09917 1/20 0.50
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TOP1 P11387 1/20 0.47
P2RY14 Q15391 1/20 0.44
GRM5 P41594 1/20 0.44
CCNB2 O95067 1/20 0.44
CDK1 P06493 1/20 0.44
CDK4 P11802 1/20 0.44
CCNB1 P14635 1/20 0.44
CCND1 P24385 1/20 0.44
CCNB3 Q8WWL7 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.43

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
SCHEMBL18255921 0.82 GAA (0.50) RAB9ANPC1L3MBTL1
SCHEMBL4483973 0.81 ALOX5 (0.59) MAOAMAOBALOX5RAB9ANPC1
SCHEMBL1648301 0.81 BACE1 (0.58) MAOAMAOBALOX5MAPTTOP1
SCHEMBL29385685 0.78 ALOX5 (0.54) MAOAMAOBALOX5RAB9ANPC1
SCHEMBL26124646 0.78 ALOX5 (0.54) MAOAMAOBALOX5RAB9ANPC1
SCHEMBL8327914 0.77 MAOA (0.61) MAOAMAOBALOX5RAB9ANPC1
SCHEMBL7066126 0.77 PDGFRB (0.53) MAOAMAOBALOX5TOP1
SCHEMBL1646735 0.75 BACE1 (0.49) MEN1KMT2AERN1CYP3A4
SCHEMBL3615463 0.75 MAOB (0.58) MAOAMAOBALOX5RAB9ANPC1
SCHEMBL20868587 0.74 ALOX5 (0.51) MAOBALOX5RAB9ANPC1MAPT

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-20190099747-A1 NANO-TO-NANO FE/PPM Pd CATALYSIS OF CROSS-COUPLING REACTIONS IN WATER UNIV CALIFORNIA (US) 2019-04-04 US disclosed
US-10189016-B2 Nano-to-nano Fe/ppm Pd catalysis of cross-coupling reactions in water THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-01-29 US disclosed
US-9956551-B2 Nano-to-nano Fe/ppm Pd catalysis of cross-coupling reactions in water THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-05-01 US disclosed
US-20170341069-A1 NANO-TO-NANO FE/PPM Pd CATALYSIS OF CROSS-COUPLING REACTIONS IN WATER UNIV CALIFORNIA (US) 2017-11-30 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 (3 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-20190099747-A1 NANO-TO-NANO FE/PPM Pd CATALYSIS OF CROSS-COUPLING REACTIONS IN WATER SOD1, MPO, TFRC MAOA 535/4885MAOB 753/4885ALOX5 3097/4885
US-10189016-B2 Nano-to-nano Fe/ppm Pd catalysis of cross-coupling reactions in water SOD1, MPO, TFRC MAOA 535/4885MAOB 753/4885ALOX5 3097/4885
US-20170341069-A1 NANO-TO-NANO FE/PPM Pd CATALYSIS OF CROSS-COUPLING REACTIONS IN WATER SOD1, MPO, TFRC MAOA 535/4885MAOB 753/4885ALOX5 3097/4885

“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.