SCHEMBL4080147

SCHEMBL4080147

Cc1sc(NC(=O)C2C(C)(C)C2(C)C)c(C(=O)NC(C)CCc2ccccc2)c1C

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.52
ALDH1A1 P00352 4/20 0.52
KMT2A Q03164 5/20 0.49
MEN1 O00255 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HTT P42858 1/20 0.49
POLB P06746 4/20 0.47
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
USP2 O75604 1/20 0.45
TSHR P16473 1/20 0.45
HSP90AA1 P07900 1/20 0.45
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
PLA2G1B P04054 1/20 0.45
MAPK1 P28482 1/20 0.45
ATG4B Q9Y4P1 1/20 0.45

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
SCHEMBL4092618 0.81 CYP1A2 (0.51) HPGDALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL4080979 0.79 ALDH1A1 (0.60) HPGDALDH1A1SMN1; SMN2POLBCYP1A2
SCHEMBL4091302 0.77 ALDH1A1 (0.48) HPGDALDH1A1SMN1; SMN2POLBCYP1A2
SCHEMBL4090409 0.76 ALDH1A1 (0.44) HPGDALDH1A1KMT2APOLBCYP1A2
SCHEMBL4090818 0.73 ALDH1A1 (0.43) HPGDALDH1A1POLBCYP1A2CYP2C19
SCHEMBL4080663 0.73 TAS1R3 (0.43) HPGDALDH1A1KMT2ASMN1; SMN2POLB
SCHEMBL3745498 0.72 ABCC1 (0.51) HPGDALDH1A1KMT2AMEN1POLB
SCHEMBL4085942 0.71 CYP1A2 (0.40) HPGDALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL4091044 0.70 ALDH1A1 (0.49) HPGDALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL4080940 0.70 CNR2 (0.44) HPGDALDH1A1SMN1; SMN2POLBCYP1A2

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-8338623-B2 N-{3-[(2,5-dimethylmorpholin-4-yl)carbonyl]-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl}hexahydro-2,5-methanopentalene-3a(1H)-carboxamide; CB2 receptors ligand; antiinflammatory, analgesic agent; autoimmune diseases; neuroprotectants ABBVIE INC. (US) 2012-12-25 US disclosed
US-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-01-15 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-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 HPGD 1873/4885ALDH1A1 1504/4885KMT2A 2505/4885

“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.