SCHEMBL14907677

SCHEMBL14907677

NCc1cccc(CNC(=S)NCc2ccnc3[nH]ccc23)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
ALOX12 P18054 3/20 0.45
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
PRKCI P41743 3/20 0.42
CDK8 P49336 1/20 0.39
GAA P10253 2/20 0.37
RET P07949 1/20 0.36
CYP19A1 P11511 1/20 0.36
HPGD P15428 1/20 0.36
CDC7 O00311 1/20 0.36
DBF4 Q9UBU7 1/20 0.36
AKT2 P31751 1/20 0.36
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
NUDT1 P36639 1/20 0.35
CIT O14578 1/20 0.35

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
SCHEMBL14907647 0.89 ALDH1A1 (0.42) ALDH1A1ALOX12MAPTLMNAPKM
SCHEMBL14894504 0.88 KMT2A (0.43) ALDH1A1MAPTLMNAPKMPRKCI
SCHEMBL14907951 0.84 ALDH1A1 (0.40) ALDH1A1ALOX12MAPTLMNAPKM
SCHEMBL14894080 0.84 JAK3 (0.42) GAARETKMT2ACIT
SCHEMBL14907843 0.83 IKBKB (0.40) ALDH1A1PRKCICDK8RETAKT2
SCHEMBL14907675 0.81 BRD4 (0.42) ALDH1A1ALOX12MAPTLMNAPKM
SCHEMBL14907663 0.81 AKT1 (0.44) PRKCICDK8RETNUDT1CIT
SCHEMBL14907756 0.80 AXL (0.41) ALDH1A1MAPTLMNAPRKCIGAA
SCHEMBL14894239 0.80 ALOX12 (0.42) ALDH1A1ALOX12MAPTLMNAPKM
SCHEMBL14894457 0.79 BRAF (0.40) ALDH1A1ALOX12MAPTLMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174984-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-11-03 US disclosed
US-20140296204-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-10-02 US disclosed
WO-2013062945-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-05-02 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-20140296204-A1 CHEMICAL COMPOUNDS DNMT1, DNMT3A, DNMT3B ALDH1A1 1016/4885ALOX12 3765/4885MAPT 3746/4885

“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.