SCHEMBL1789180

SCHEMBL1789180

Cc1cc(Cl)c(C(N)=O)cc1-n1cccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.42
MAPT P10636 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
G6PD P11413 1/20 0.41
HCAR1 Q9BXC0 1/20 0.40
SYK P43405 1/20 0.39
AVPR2 P30518 1/20 0.37
NTRK1 P04629 1/20 0.36
HCRTR1 O43613 4/20 0.35
HCRTR2 O43614 4/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NNMT P40261 1/20 0.35
ELANE P08246 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
SCHEMBL3709384 0.87 ALDH1A1 (0.42) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL1786708 0.87 CAPN1 (0.47) CAPN1MAPTMEN1KMT2AALDH1A1
SCHEMBL1784767 0.84 HCAR1 (0.41) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL1783427 0.83 CAPN1 (0.42) CAPN1MAPTMEN1KMT2AALDH1A1
SCHEMBL1785351 0.83 CAPN1 (0.42) CAPN1MAPTMEN1KMT2AALDH1A1
SCHEMBL1788949 0.80 IRAK4 (0.45) CAPN1MAPTMEN1KMT2AALDH1A1
SCHEMBL1787503 0.80 HCAR1 (0.46) CAPN1MAPTMEN1KMT2AALDH1A1
SCHEMBL1785239 0.74 CAPN1 (0.54) CAPN1MAPTMEN1KMT2AALDH1A1
SCHEMBL16666154 0.74 NOTUM (0.46) CAPN1MAPTMEN1KMT2AALDH1A1
SCHEMBL3704400 0.74 ALDH1A1 (0.46) CAPN1MAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130203730-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2013-08-08 US disclosed
EP-2607357-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS Astrazeneca AB (SE) 2013-06-26 EP disclosed
US-20120115845-A1 THERAPEUTIC AGENTS ALLEN JACK MCQUEEN (GB) 2012-05-10 US disclosed
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-05-26 US disclosed
CN-101883762-A Benzothiazoles as modulators of growth hormone releasing hormone receptors ASTRAZENECA AB 2010-11-10 CN disclosed
EP-2205576-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS AstraZeneca AB (SE) 2010-07-14 EP disclosed
US-20090186870-A1 Therapeutic Agents - 802 ASTRAZENECA AB (SE) 2009-07-23 US disclosed
WO-2009047558-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2009-04-16 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 (4 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-20130203730-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R CAPN1 2179/4885MAPT 3413/4885MEN1 2250/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R CAPN1 3888/4885MAPT 4086/4885MEN1 692/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R CAPN1 4166/4885MAPT 4300/4885MEN1 1253/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R CAPN1 2179/4885MAPT 3413/4885MEN1 2250/4885

“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.