SCHEMBL2367283

SCHEMBL2367283

NC(=O)c1nc(Nc2ccccc2)sc1NC(=O)CC1CCCC1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIP5K1C O60331 1/20 0.69
TNIK Q9UKE5 11/20 0.55
MAPT P10636 5/20 0.55
EPHX2 P34913 2/20 0.54
TP53 P04637 2/20 0.53
LMNA P02545 2/20 0.53
POLB P06746 1/20 0.53
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL16700461 0.89 TNIK (0.70) TNIK
SCHEMBL22468228 0.82 PIP5K1C (1.00) PIP5K1CTNIKMAPTTP53LMNA
SCHEMBL2367246 0.78 TNIK (0.65) PIP5K1CTNIKMAPTTP53LMNA
SCHEMBL2366947 0.76 MAPT (0.56) PIP5K1CTNIKMAPTTP53LMNA
SCHEMBL13224732 0.76 TNIK (0.84) PIP5K1CTNIKMAPTTP53LMNA
SCHEMBL3395871 0.76 EPHX2 (0.58) EPHX2KDM4EMEN1NPC1RAB9A
SCHEMBL4922825 0.75 NPC1 (0.58) PIP5K1CEPHX2KDM4EMEN1NPC1
SCHEMBL4866294 0.73 EPHX2 (0.97) EPHX2MEN1NPC1RAB9AKMT2A
SCHEMBL3822162 0.72 EPHX2 (1.00) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL16707029 0.72 TNIK (0.92) PIP5K1CTNIK

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
EP-2364149-B1 TNIK INHIBITOR AND THE USE NAT CANCER CT (JP) 2014-05-07 EP disclosed
EP-2364149-A1 TNIK INHIBITOR AND THE USE National Cancer Center (JP) 2011-09-14 EP disclosed
US-20100216795-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI 2010-08-26 US disclosed
WO-2010064111-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI (JP) 2010-06-10 WO disclosed
US-20100137386-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI 2010-06-03 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 (2 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-20100216795-A1 TNIK INHIBITOR AND THE USE TNIK, TNNI3K, TNK1 PIP5K1C 352/4885TNIK 1/4885MAPT 3204/4885
US-20100137386-A1 TNIK INHIBITOR AND THE USE TNIK, TNNI3K, TNK1 PIP5K1C 231/4885TNIK 1/4885MAPT 2295/4885

“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.