SCHEMBL16814743

SCHEMBL16814743

CS(=O)(=O)Cc1ccc(-c2ccc3nc4n(c3c2)[C@@H](c2ccccc2)CC4)cn1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TNF P01375 10/20 0.45
RIPK1 Q13546 5/20 0.39
KCNH2 Q12809 2/20 0.36
ATM Q13315 2/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
SYK P43405 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL16796989 1.00 TNF (0.45) TNFRIPK1KCNH2ATMMEN1
SCHEMBL16814777 0.86 TNF (0.48) TNFRIPK1ATM
SCHEMBL16796836 0.86 TNF (0.48) TNFRIPK1ATM
SCHEMBL18151041 0.85 RIPK1 (0.43) TNFRIPK1MEN1ALDH1A1KMT2A
SCHEMBL31292036 0.85 RIPK1 (0.43) TNFRIPK1MEN1ALDH1A1KMT2A
SCHEMBL18162358 0.85 RIPK1 (0.43) TNFRIPK1MEN1ALDH1A1KMT2A
SCHEMBL29795024 0.85 RIPK1 (0.43) TNFRIPK1MEN1ALDH1A1KMT2A
SCHEMBL16814724 0.85 TNF (0.59) TNFRIPK1
SCHEMBL29794873 0.85 TNF (0.59) TNFRIPK1
SCHEMBL18151650 0.84 RIPK1 (0.45) TNFRIPK1MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080121-B1 FUSED TRICYCLIC BENZIMIDAZOLES DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2019-09-04 EP disclosed
US-9932343-B2 Fused tricyclic benzimidazoles derivatives as modulators of TNF activity UCB BIOPHARMA SPRL (BE) 2018-04-03 US disclosed
US-9932343-B2 Fused tricyclic benzimidazoles derivatives as modulators of TNF activity UCB BIOPHARMA SPRL (BE) 2018-04-03 US disclosed
US-20160304523-A1 Fused Tricyclic Benzimidazoles Derivatives As Modulators of TNF Activity SANOFI (FR) 2016-10-20 US disclosed
US-20160304523-A1 Fused Tricyclic Benzimidazoles Derivatives As Modulators of TNF Activity SANOFI (FR) 2016-10-20 US disclosed
WO-2015086525-A1 FUSED TRICYCLIC BENZIMIDAZOLES DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2015-06-18 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-20160304523-A1 Fused Tricyclic Benzimidazoles Derivatives As Modulators of TNF Activity TNF, TNFRSF1A, TNFRSF9 TNF 1/4885RIPK1 344/4885KCNH2 2266/4885

“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.