SCHEMBL18170870

SCHEMBL18170870

CS(=O)(=O)c1ccccc1C(=O)Nc1ccc(-c2ccccc2)c2c1C(=O)NC2

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.52
BCAT2 O15382 1/20 0.48
PABPC1 P11940 1/20 0.43
EIF4H Q15056 1/20 0.43
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.37
CASP3 P42574 1/20 0.37
MEN1 O00255 1/20 0.37
MAP3K9 P80192 1/20 0.36
MAP3K11 Q16584 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL18170808 0.85 KDR (0.58) KDRKMT2AALDH1A1MEN1
SCHEMBL18170746 0.84 KDR (0.58) KDRKMT2AALDH1A1CASP3MEN1
SCHEMBL18170718 0.83 KDR (0.59) KDRNPC1RAB9AKMT2AALDH1A1
SCHEMBL18170481 0.83 KDR (0.53) KDRNPC1RAB9AKMT2AALDH1A1
SCHEMBL18170477 0.83 KDR (0.56) KDRNPC1RAB9AKMT2AALDH1A1
SCHEMBL18170741 0.83 KDR (0.53) KDRRAB9AKMT2AALDH1A1CASP3
SCHEMBL18170699 0.82 KDR (0.55) KDRKMT2AALDH1A1CASP3MEN1
SCHEMBL18170654 0.82 CASP3 (0.54) KDRNPC1RAB9AKMT2AALDH1A1
SCHEMBL18170444 0.82 KDR (0.53) KDRRAB9AKMT2AALDH1A1MEN1
SCHEMBL18170767 0.82 KDR (0.53) KDRALDH1A1MAP3K9MAP3K11HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9856216-B2 Compounds as TNIK, IKKε and TBK1 inhibitors and pharmaceutical composition comprising same GREEN CROSS CORPORATION (KR) 2018-01-02 US claimed
US-20160311772-A1 COMPOUNDS AS TNIK, IKKEPSILON AND TBK1 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-27 US claimed
US-9856216-B2 Compounds as TNIK, IKKε and TBK1 inhibitors and pharmaceutical composition comprising same GREEN CROSS CORPORATION (KR) 2018-01-02 US disclosed
US-20160311772-A1 COMPOUNDS AS TNIK, IKKEPSILON AND TBK1 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-27 US disclosed
US-20160311772-A1 COMPOUNDS AS TNIK, IKKEPSILON AND TBK1 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-27 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-20160311772-A1 COMPOUNDS AS TNIK, IKKEPSILON AND TBK1 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME TNIK, TNK1, NFKBIA KDR 1662/4885BCAT2 3960/4885PABPC1 2913/4885

“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.