SCHEMBL9812359

SCHEMBL9812359

CCCC(C)(C)c1ccc(N)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
CNR2 P34972 7/20 0.47
CNR1 P21554 4/20 0.47
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 2/20 0.42
HPGD P15428 1/20 0.42
ESR1 P03372 4/20 0.40
ESR2 Q92731 3/20 0.40
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
TAAR1 Q96RJ0 1/20 0.37
KIF11 P52732 1/20 0.37
PSMD14 O00487 1/20 0.37
CYP3A4 P08684 1/20 0.37
RECQL P46063 1/20 0.37
GFER P55789 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL2028907 0.87 CNR2 (0.56) MAPTNPC1RAB9ACNR2CNR1
SCHEMBL28585334 0.84 CNR2 (0.66) MAPTNPC1RAB9ACNR2CNR1
SCHEMBL22043106 0.84 CNR2 (0.66) MAPTNPC1RAB9ACNR2CNR1
SCHEMBL29193377 0.84 CNR2 (0.66) MAPTNPC1RAB9ACNR2CNR1
SCHEMBL24272949 0.82 MAPT (0.50) MAPTNPC1RAB9ACNR2CNR1
SCHEMBL10803424 0.82 MAPT (0.46) MAPTNPC1RAB9ACNR2CNR1
SCHEMBL18930278 0.81 TSHR (0.46) CNR2CNR1ESR1ESR2TSHR
SCHEMBL582676 0.81 NPC1 (0.77) MAPTNPC1RAB9ACNR2CNR1
SCHEMBL13523937 0.79 ESR1 (0.61) MAPTNPC1RAB9ACNR2CNR1
SCHEMBL23616384 0.79 CNR2 (0.44) MAPTNPC1RAB9ACNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11040028-B2 Penicinotam derivative, preparation method and use thereof OCEAN UNIVERSITY OF CHINA (CN) 2021-06-22 US disclosed
US-20110080547-A1 LIQUID CRYSTAL DISPLAY DEVICE JAPAN DISPLAY EAST INC. (JP) 2011-04-07 US disclosed
EP-0257882-B1 N-PHENYL BUTENAMIDES WITH PHARMACEUTICAL PROPERTIES LILLY INDUSTRIES LIMITED (GB) 1991-07-24 EP disclosed
US-4892963-A IMMUNE DISEASES LILLY INDUSTRIES LIMITED (GB) 1990-01-09 US disclosed
EP-0257882-A1 N-Phenyl butenamides with pharmaceutical properties LILLY INDUSTRIES LIMITED (GB) 1988-03-02 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 (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-11040028-B2 Penicinotam derivative, preparation method and use thereof TPMT, MAPT, TLR4 MAPT 2/4885NPC1 1374/4885RAB9A 3833/4885

“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.