SCHEMBL926070

SCHEMBL926070

Clc1cc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)c(Cl)nn1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 2/20 0.35
ALDH1A1 P00352 3/20 0.35
PKM P14618 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
VNN1 O95497 1/20 0.32
KIF11 P52732 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL27694380 0.76 KCNN4 (0.35) KCNN4KIF11TSHR
SCHEMBL11821391 0.73 ALDH1A1 (0.52) ALDH1A1PKMTDP1RAB9AL3MBTL1
SCHEMBL31201521 0.69 PKM (0.46) PKML3MBTL1TSHR
SCHEMBL23338555 0.68 TDP1 (0.48) ALDH1A1PKMTDP1RAB9AL3MBTL1
SCHEMBL17108576 0.67 VNN1 (0.34) VNN1
SCHEMBL30904778 0.67 CCNC (0.48) ALDH1A1PKMRAB9AL3MBTL1
SCHEMBL29206789 0.67 CCNC (0.48) ALDH1A1PKMRAB9AL3MBTL1
SCHEMBL20459591 0.67 TACR1 (0.31) VNN1
SCHEMBL527009 0.66 CYP2A6 (0.43) ALDH1A1PKMTDP1RAB9AL3MBTL1
SCHEMBL30041839 0.66 CYP2A6 (0.43) ALDH1A1PKMTDP1RAB9AL3MBTL1

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-7868188-B2 5-heteroaryl thiazoles and their use as PI3K inhibitors ASTRAZENECA AB (SE) 2011-01-11 US disclosed
EP-1841763-B1 5-HETEROARYL THIAZOLES AND THEIR USE AS PI3K INHIBITORS ASTRAZENECA AB (SE) 2010-06-30 EP disclosed
US-20080132502-A1 5-Heteroaryl Thiazoles And Their Use As PI3K Inhibitors ASTRAZENECA AB (SE) 2008-06-05 US disclosed
EP-1841763-A1 5-HETEROARYL THIAZOLES AND THEIR USE AS PI3K INHIBITORS AstraZeneca AB (SE) 2007-10-10 EP disclosed
WO-2006051270-A1 5-HETEROARYL THIAZOLES AND THEIR USE AS P13K INHIBITORS ASTRAZENECA AB (SE) 2006-05-18 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-20080132502-A1 5-Heteroaryl Thiazoles And Their Use As PI3K Inhibitors MTOR, PIK3R5, PIK3CA KCNN4 4773/4885ALDH1A1 2310/4885PKM 459/4885

“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.