SCHEMBL1614285

SCHEMBL1614285

c1ccc(-c2cnn3ccsc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.39
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
PDPK1 O15530 1/20 0.36
PIM1 P11309 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RET P07949 1/20 0.35
TDO2 P48775 1/20 0.34
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAK O14976 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL18160954 0.68 CAMKK1 (0.50) KDRRAB9ANPC1PIM1MEN1
SCHEMBL8813542 0.66 RAB9A (0.44) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL1659942 0.64 KDR (0.39) KDRRAB9ANPC1PIM1MEN1
SCHEMBL7112314 0.64 KDR (0.59) KDRRAB9ANPC1PIM1MEN1
SCHEMBL15286421 0.63 CAMKK1 (0.56) KDRRAB9ANPC1PIM1MEN1
SCHEMBL10508644 0.59 HIF1A (0.53) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL23400268 0.57 CREBBP (0.45) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL21135430 0.56 HTR2A (0.42) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL23399371 0.56 NPC1 (0.62) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL21447 0.55 ALDH1A1 (0.61) RAB9ANPC1ALDH1A1HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8530504-B2 Pyrazolothiazole compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-09-10 US disclosed
CN-102007133-B 3-phenylpyrazolo [5,1-b ] thiazole compounds EISAI R&D MAN CO LTD 2013-06-12 CN disclosed
US-8431603-B2 3-phenylpyrazolo[5,1-b]thiazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-04-30 US disclosed
US-8431603-B2 3-phenylpyrazolo[5,1-b]thiazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-04-30 US disclosed
EP-2266990-B1 3-PHENYLPYRAZOLO[5,1-b]THIAZOLE COMPOUND EISAI R&D MAN CO LTD (JP) 2012-09-26 EP disclosed
EP-2487177-A1 PYRAZOLOXAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2012-08-15 EP disclosed
EP-2487178-A1 PYRAZOLOTHIAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2012-08-15 EP disclosed
US-20110086882-A1 PYRAZOLOTHIAZOLE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-04-14 US disclosed
CN-102007133-A 3-phenylpyrazolo [5,1-b ] thiazole compounds EISAI R&D MAN CO LTD 2011-04-06 CN disclosed
EP-2266990-A1 3-PHENYLPYRAZOLOÝ5,1-b¨THIAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2010-12-29 EP disclosed
US-20090259049-A1 3-PHENYLPYRAZOLO[5,1-b]THIAZOLE COMPOUNDS EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-10-15 US 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-20110086882-A1 PYRAZOLOTHIAZOLE COMPOUND CRHR1, CNR1, AGTR1 KDR 2359/4885RAB9A 1985/4885NPC1 1707/4885
US-20090259049-A1 3-PHENYLPYRAZOLO[5,1-b]THIAZOLE COMPOUNDS CRHR1, AGTR1, CRHR2 KDR 848/4885RAB9A 2475/4885NPC1 616/4885

“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.