SCHEMBL425596

SCHEMBL425596

CCCCOc1ccc(OC2CCN(C(=O)n3nnc4ccccc43)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.61
AMY1A P0DUB6 1/20 0.61
GAA P10253 1/20 0.61
SI P14410 1/20 0.61
MGAM2 Q2M2H8 1/20 0.61
FAAH O00519 14/20 0.54
MGLL Q99685 14/20 0.54
MAPT P10636 2/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
KMT2A Q03164 1/20 0.50
HSD17B10 Q99714 1/20 0.50
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL427629 0.86 MGLL (0.69) MGAMAMY1AGAASIMGAM2
SCHEMBL427547 0.86 MGLL (0.57) FAAHMGLL
SCHEMBL425679 0.86 MGLL (0.64) FAAHMGLL
SCHEMBL425761 0.86 FAAH (0.62) FAAHMGLL
SCHEMBL427623 0.84 FAAH (0.61) FAAHMGLL
SCHEMBL425581 0.80 MGLL (0.63) MGAMAMY1AGAASIMGAM2
SCHEMBL424479 0.80 MGLL (0.60) MGAMAMY1AGAASIMGAM2
SCHEMBL7900062 0.78 FAAH (0.60) MGAMAMY1AGAASIMGAM2
SCHEMBL426890 0.78 MGLL (0.66) MGAMAMY1AGAASIMGAM2
SCHEMBL5967891 0.77 FAAH (0.58) FAAHMGLL

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-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
WO-2010074588-A2 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2010-07-01 WO 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-20120065191-A1 PHARMACEUTICAL COMPOUNDS FAAH, FAAH2, ASAH1 MGAM 1034/4885AMY1A 955/4885GAA 184/4885

“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.