SCHEMBL6804796

SCHEMBL6804796

COc1ccc(-c2ccccc2C(=O)Nc2ccc3c(c2)CCN3C(=O)Cc2cccc(N)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
POLB P06746 1/20 0.46
AVPR2 P30518 1/20 0.45
AVPR1A P37288 1/20 0.45
KDM4E B2RXH2 2/20 0.44
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 2/20 0.43
EIF2AK3 Q9NZJ5 4/20 0.43
RIPK1 Q13546 3/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
NFKB1 P19838 1/20 0.42
MAOB P27338 1/20 0.42
NFKB2 Q00653 1/20 0.42

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
SCHEMBL6803357 0.91 EIF2AK3 (0.46) POLBAVPR2AVPR1AMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL6804708 0.91 EIF2AK3 (0.45) POLBAVPR2AVPR1AMAPTSMN1; SMN2
SCHEMBL6803323 0.90 EIF2AK3 (0.43) POLBAVPR2AVPR1AMAPTEIF2AK3
SCHEMBL6800625 0.89 EIF2AK3 (0.43) AVPR2AVPR1AMAPTEIF2AK3RIPK1
SCHEMBL6804404 0.89 EIF2AK3 (0.44) AVPR2AVPR1AKDM4EMAPTRAB9A
SCHEMBL6802195 0.88 EIF2AK3 (0.49) GAAPOLBAVPR2AVPR1AKDM4E
SCHEMBL6805225 0.88 GAA (0.43) GAAPOLBAVPR2AVPR1AKDM4E
SCHEMBL6803963 0.88 GAA (0.44) GAAPOLBAVPR2AVPR1AKDM4E
SCHEMBL6667700 0.88 SMO (0.49) GAAKDM4EMAPTEIF2AK3RIPK1
Hydrochloric Acid SCHEMBL6805924 0.87 SMO (0.49) GAAKDM4EMAPTEIF2AK3RIPK1

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 GAA 2694/4885POLB 1962/4885AVPR2 837/4885

“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.