SCHEMBL1468580

SCHEMBL1468580

CCCCCCCCc1ccc(N2Cc3ccc(N)cc3C2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.46
MGLL Q99685 1/20 0.46
HTR2A P28223 1/20 0.43
S1PR1 P21453 6/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
GRM2 Q14416 1/20 0.39
CNR2 P34972 1/20 0.39
DHFR P00374 1/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL1468034 1.00 FAAH (0.46) FAAHMGLLHTR2AS1PR1KDM4E
SCHEMBL1468037 0.95 ALDH1A1 (0.42) FAAHMGLLHTR2AS1PR1KDM4E
SCHEMBL1467554 0.90 FAAH (0.46) FAAHMGLLHTR2AS1PR1KDM4E
SCHEMBL1468089 0.90 FAAH (0.46) FAAHMGLLHTR2AS1PR1KDM4E
SCHEMBL1468655 0.90 NPC1 (0.43) MGLLKDM4EALDH1A1HPGDRAB9A
SCHEMBL1468412 0.85 NPC1 (0.42) FAAHMGLLS1PR1ALDH1A1RAB9A
SCHEMBL1468040 0.85 FAAH (0.43) FAAHMGLLS1PR1ALDH1A1RAB9A
SCHEMBL1467542 0.85 FAAH (0.43) FAAHMGLLS1PR1ALDH1A1RAB9A
SCHEMBL1467991 0.81 TNF (0.49) FAAHKDM4EALDH1A1HPGDRAB9A
SCHEMBL1468601 0.80 NPC1 (0.43) MGLLHTR2AKDM4EALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722723-B2 Aromatic amide derivative RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2014-05-13 US disclosed
US-20110071304-A1 AROMATIC AMIDE DERIVATIVE RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-03-24 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-20110071304-A1 AROMATIC AMIDE DERIVATIVE NCOR2, NCOR1, EP300 FAAH 2385/4885MGLL 3588/4885HTR2A 1802/4885

“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.