SCHEMBL6805312

SCHEMBL6805312

CCc1ccc(-c2ccccc2C(=O)Nc2ccc3c(c2)CCN3C(=O)Cc2ccnc(N)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EIF2AK3 Q9NZJ5 9/20 0.43
EIF2AK1 Q9BQI3 2/20 0.43
CYP11B1 P15538 2/20 0.42
CYP11B2 P19099 2/20 0.42
RIPK1 Q13546 3/20 0.41
CREBBP Q92793 1/20 0.40
ROCK2 O75116 1/20 0.39
KLK7 P49862 1/20 0.39
AVPR2 P30518 1/20 0.39
OXTR P30559 1/20 0.39
AVPR1A P37288 1/20 0.39
SMO Q99835 1/20 0.39
LCK P06239 1/20 0.39
AURKB Q96GD4 1/20 0.39
SYK P43405 1/20 0.39
PDGFRB P09619 1/20 0.38
KDR P35968 1/20 0.38

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
SCHEMBL6804764 0.92 MAPT (0.44) EIF2AK3EIF2AK1CYP11B1CYP11B2RIPK1
SCHEMBL6669273 0.92 CYP11B1 (0.44) EIF2AK3EIF2AK1CYP11B1CYP11B2RIPK1
SCHEMBL6803323 0.89 EIF2AK3 (0.43) EIF2AK3EIF2AK1CYP11B1CYP11B2RIPK1
SCHEMBL6809825 0.89 SMO (0.50) RIPK1SMO
SCHEMBL6804333 0.88 KLK7 (0.39) EIF2AK3EIF2AK1CYP11B1CYP11B2RIPK1
SCHEMBL6672281 0.88 EIF2AK3 (0.49) EIF2AK3CYP11B1CYP11B2CREBBPROCK2
SCHEMBL6671845 0.85 CYP11B1 (0.43) EIF2AK3EIF2AK1CYP11B1CYP11B2RIPK1
SCHEMBL6803618 0.84 RIPK1 (0.40) EIF2AK3CYP11B1CYP11B2RIPK1CREBBP
SCHEMBL6667572 0.82 HTR2A (0.43) EIF2AK3EIF2AK1CYP11B1CYP11B2RIPK1
SCHEMBL6803784 0.82 EIF2AK3 (0.53) EIF2AK3EIF2AK1CYP11B1CYP11B2RIPK1

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-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 US claimed
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 2638/4885EIF2AK1 2837/4885CYP11B1 61/4885

“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.