SCHEMBL16396278

SCHEMBL16396278

CCOC(=O)c1sc2cc(N)ccc2c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.51
KMT2A Q03164 8/20 0.51
MEN1 O00255 7/20 0.51
MAPT P10636 11/20 0.50
RAB9A P51151 8/20 0.50
NPC1 O15118 6/20 0.50
LMNA P02545 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 1/20 0.47
MAOA P21397 1/20 0.47
KDM4E B2RXH2 8/20 0.47
HSD17B10 Q99714 6/20 0.47
HPGD P15428 5/20 0.47
GAA P10253 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TSHR P16473 2/20 0.47
GLA P06280 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
ALOX15 P16050 2/20 0.46

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
SCHEMBL3488612 0.89 ALDH1A1 (0.51) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL2824300 0.86 LMNA (0.45) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL31011039 0.83 MAPT (0.50) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL3680399 0.83 MCL1 (0.50) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL25810203 0.83 MAPT (0.50) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL11247750 0.80 LMNA (0.59) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL29513035 0.79 ALDH1A1 (0.64) ALDH1A1KMT2AMEN1MAPTLMNA
SCHEMBL9025206 0.79 ALDH1A1 (0.64) ALDH1A1KMT2AMEN1MAPTLMNA
Hydrochloric Acid SCHEMBL11231115 0.79 LMNA (0.58) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL20784090 0.78 MEN1 (0.44) ALDH1A1KMT2AMEN1MAPTLMNA

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-10562912-B2 Heterocyclic derivatives and use thereof C&C RESEARCH LABORATORIES (KR) 2020-02-18 US disclosed
EP-3004057-B1 HETEROCYCLIC DERIVATIVES AND THEIR USE AS STAT 3 INHIBITORS C&C RES LAB (KR) 2018-07-25 EP disclosed
US-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2016-04-21 US disclosed
EP-3004057-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C Research Laboratories (KR) 2016-04-13 EP disclosed
WO-2014196793-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2014-12-11 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 (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-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF STAT3, JAK2, STAT5A ALDH1A1 1646/4885KMT2A 3017/4885MEN1 3206/4885
US-10562912-B2 Heterocyclic derivatives and use thereof STAT3, JAK2, STAT5A ALDH1A1 1646/4885KMT2A 3017/4885MEN1 3206/4885

“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.