SCHEMBL1785035

SCHEMBL1785035

O=C(O)c1cc(-c2ccccn2)ccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.60
DHODH Q02127 2/20 0.56
NTRK1 P04629 1/20 0.50
KMO O15229 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.48
KDM4E B2RXH2 2/20 0.47
KDM6B O15054 1/20 0.47
KDM4A O75164 1/20 0.47
KDM5C P41229 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
KDM2A Q9Y2K7 1/20 0.47
KDM3A Q9Y4C1 1/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 2/20 0.47
PTGER1 P34995 1/20 0.47
PKM P14618 1/20 0.46
KAT6A Q92794 1/20 0.46
CNR1 P21554 1/20 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
SCHEMBL1787982 0.88 P2RX7 (0.60) P2RX7DHODHNTRK1SMN1; SMN2LMNA
SCHEMBL4178497 0.88 DHODH (0.56) P2RX7DHODHKMOSMN1; SMN2LMNA
SCHEMBL21599109 0.85 DHODH (0.60) P2RX7DHODHSMN1; SMN2LMNAKDM4E
SCHEMBL10959096 0.83 MCL1 (0.62) DHODHKDM4EKDM6BKDM4AKDM5C
SCHEMBL30614608 0.83 MCL1 (0.62) DHODHKDM4EKDM6BKDM4AKDM5C
SCHEMBL1788339 0.82 P2RX7 (0.58) P2RX7NTRK1SMN1; SMN2LMNAKDM4E
SCHEMBL15173237 0.81 DHODH (0.56) P2RX7DHODHLMNAKDM4EKDM6B
SCHEMBL18311299 0.81 KAT6A (0.62) P2RX7DHODHKMOKDM4EKDM6B
SCHEMBL16995118 0.80 PIM2 (0.52) P2RX7DHODHKMOALDH1A1TP53
SCHEMBL29106054 0.79 HNF4A (0.62) DHODHSMN1; SMN2LMNAKDM4EKDM6B

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 16 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
US-20130203730-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2013-08-08 US disclosed
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-20120115845-A1 THERAPEUTIC AGENTS ALLEN JACK MCQUEEN (GB) 2012-05-10 US 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
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-05-26 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
US-20090186870-A1 Therapeutic Agents - 802 ASTRAZENECA AB (SE) 2009-07-23 US 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 P2RX7 1380/4885DHODH 3893/4885NTRK1 846/4885
US-20120115845-A1 THERAPEUTIC AGENTS GPR119, MC2R, MC4R P2RX7 3387/4885DHODH 2548/4885NTRK1 4020/4885
US-20090186870-A1 Therapeutic Agents - 802 GPR119, SLC5A2, MC2R P2RX7 1340/4885DHODH 2506/4885NTRK1 3916/4885
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS GPR119, GHSR, GLP1R P2RX7 1380/4885DHODH 3893/4885NTRK1 846/4885

“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.