SCHEMBL6803776

SCHEMBL6803776

Cc1ccc(C)n1-c1cccc(CC(=O)N2CCc3cc(NC(=O)c4ccccc4-c4ccc(N(C)C)cc4)ccc32)n1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EIF2AK3 Q9NZJ5 3/20 0.39
RIPK1 Q13546 2/20 0.39
CREBBP Q92793 1/20 0.39
MAPT P10636 2/20 0.38
TP53 P04637 3/20 0.38
AVPR2 P30518 4/20 0.37
AVPR1A P37288 2/20 0.37
HTR2C P28335 1/20 0.37
NPY2R P49146 2/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CNR1 P21554 1/20 0.36
OXTR P30559 1/20 0.36
SMO Q99835 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL6804990 0.93 MAPT (0.44) EIF2AK3RIPK1CREBBPMAPTTP53
SCHEMBL6666848 0.92 TP53 (0.39) EIF2AK3RIPK1CREBBPMAPTTP53
SCHEMBL6803618 0.91 RIPK1 (0.40) EIF2AK3RIPK1CREBBPMAPTTP53
SCHEMBL6805225 0.90 GAA (0.43) EIF2AK3RIPK1CREBBPMAPTTP53
SCHEMBL6806327 0.90 EIF2AK3 (0.41) EIF2AK3RIPK1CREBBPMAPTTP53
SCHEMBL6805396 0.89 SMO (0.47) SMN1; SMN2SMO
SCHEMBL6800625 0.88 EIF2AK3 (0.43) EIF2AK3RIPK1CREBBPMAPTTP53
SCHEMBL6500674 0.87 TP53 (0.40) EIF2AK3RIPK1CREBBPMAPTTP53
SCHEMBL6665768 0.86 MAPT (0.41) EIF2AK3RIPK1CREBBPMAPTTP53
SCHEMBL6799551 0.86 EIF2AK3 (0.49) EIF2AK3CREBBPAVPR2AVPR1AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 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-20040157866-A1 Amide compounds APOB, NR1H2, NR1H3 EIF2AK3 2638/4885RIPK1 3523/4885CREBBP 1901/4885

“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.