SCHEMBL2897272

SCHEMBL2897272

Cc1cccc(-c2cn[c]s2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.41
METAP2 P50579 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACHE P22303 2/20 0.38
NISCH Q9Y2I1 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
XDH P47989 1/20 0.36
KDR P35968 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
BCHE P06276 1/20 0.36

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
SCHEMBL17626104 0.81 LMNA (0.34) METAP2ALDH1A1KMT2ARAB9ANPC1
SCHEMBL69540 0.81 KDR (0.40) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL1900288 0.79 BACE1 (0.41) IDO1RAB9ANPC1TSHRSMN1; SMN2
SCHEMBL9955273 0.79 HSD17B1 (0.45) IDO1MEN1KMT2AHSD17B1HSD17B2
SCHEMBL17028871 0.76 IDO1 (0.46) IDO1ALDH1A1RAB9AXDHADORA1
SCHEMBL4757273 0.74 ACHE (0.41) IDO1METAP2ALDH1A1MEN1KMT2A
SCHEMBL8876829 0.72 KDM4E (0.50) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL209262 0.71 MAPT (0.42) IDO1ALDH1A1HPGDKDR
SCHEMBL1416534 0.70 ACHE (0.41) IDO1METAP2ALDH1A1MEN1KMT2A
SCHEMBL19741486 0.70 HSD17B1 (0.56) ALDH1A1MEN1KMT2AHSD17B1HSD17B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2160187-B1 SPIROINDALONES MERCK SHARP & DOHME (US) 2013-05-22 EP claimed
US-20100137297-A1 SPIROINDALONES MERCK SHARP & DOHME LLC 2010-06-03 US claimed
CN-101678011-A Spiro-indolinone compounds MERCK & CO INC 2010-03-24 CN claimed
EP-2160187-A1 SPIROINDALONES Merck Sharp & Dohme Corp. (US) 2010-03-10 EP claimed
WO-2008144266-A1 SPIROINDALONES MERCK & CO., INC. (US) 2008-11-27 WO claimed
EP-2160187-B1 SPIROINDALONES MERCK SHARP & DOHME (US) 2013-05-22 EP disclosed
US-8309544-B2 Spiroindalones MERCK SHARP & DOHME CORP. (US) 2012-11-13 US disclosed
CN-101678011-B Spiro-indolinone compounds MERCK SHARP & DOHME 2012-07-18 CN disclosed
WO-2012085852-A1 3,8-DIAZA-BICYCLO[4.2.0]OCT-8-YL AMIDES ACTELION PHARMACEUTICALS LTD (CH) 2012-06-28 WO disclosed
WO-2012085857-A1 3,8-DIAZA-BICYCLO[4.2.0]OCT-3-YL AMIDES ACTELION PHARMACEUTICALS LTD (CH) 2012-06-28 WO disclosed
US-20100137297-A1 SPIROINDALONES MERCK SHARP & DOHME LLC 2010-06-03 US disclosed
CN-101678011-A Spiro-indolinone compounds MERCK & CO INC 2010-03-24 CN disclosed
EP-2160187-A1 SPIROINDALONES Merck Sharp & Dohme Corp. (US) 2010-03-10 EP disclosed
WO-2008144266-A1 SPIROINDALONES MERCK & CO., INC. (US) 2008-11-27 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-20100137297-A1 SPIROINDALONES HIF1AN, HIF1A, EGLN2 IDO1 2073/4885METAP2 3750/4885ALDH1A1 78/4885

“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.