SCHEMBL9954813

SCHEMBL9954813

Cc1cccc(-c2cnc(N)s2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
RAB9A P51151 5/20 0.51
NPC1 O15118 4/20 0.51
MAPT P10636 2/20 0.51
POLB P06746 2/20 0.51
CASP3 P42574 1/20 0.51
GFER P55789 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HSD17B1 P14061 3/20 0.51
HSD17B2 P37059 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
CSNK2A1 P68400 1/20 0.49
BACE1 P56817 1/20 0.47
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL3459364 0.82 HSD17B1 (0.54) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL12601168 0.82 MAP4K4 (0.53) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL3500308 0.82 CSNK2A1 (0.59) ALDH1A1RAB9ANPC1MAPTPOLB
SCHEMBL69900 0.81 CSNK2A1 (0.62) ALDH1A1RAB9ANPC1MAPTSMN1; SMN2
Bromide SCHEMBL22834317 0.80 CSNK2A1 (0.61) ALDH1A1RAB9ANPC1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL11145599 0.80 CSNK2A1 (0.61) ALDH1A1RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL2406426 0.79 CSNK2A1 (0.49) ALDH1A1RAB9ANPC1MAPTPOLB
SCHEMBL9954919 0.79 HSD17B1 (0.51) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL29389381 0.79 CSNK2A1 (0.49) ALDH1A1RAB9ANPC1MAPTPOLB
SCHEMBL2406300 0.79 KDM4E (0.54) ALDH1A1MEN1KMT2ARAB9ANPC1

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-3741757-B1 DIHYDROINDOLIZINONE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2023-07-26 EP disclosed
CN-111630052-B Dihydroindazinone derivatives 第一三共株式会社 2023-04-18 CN disclosed
US-11530211-B2 Dihydroindolizinone derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-12-20 US disclosed
US-20220339260-A1 METHOD FOR PRODUCING INSULIN-PRODUCING CELL USING DIHYDROINDOLIZINONE DERIVATIVES TOKYO INSTITUTE OF TECHNOLOGY (JP) 2022-10-27 US disclosed
EP-3998107-A1 METHOD FOR PRODUCING INSULIN-PRODUCING CELL USING DIHYDROINDOLIZINONE DERIVATIVES Tokyo Institute of Technology (JP) 2022-05-18 EP disclosed
CN-114040966-A Method for producing insulin-producing cell using dihydroindolizinone derivative 国立大学法人东京工业大学 2022-02-11 CN disclosed
US-20210053965-A1 DIHYDROINDOLIZINONE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-02-25 US disclosed
EP-3741757-A1 DIHYDROINDOLIZINONE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2020-11-25 EP disclosed
CN-111630052-A Dihydroindazinone derivatives 第一三共株式会社 2020-09-04 CN disclosed
WO-2019142883-A1 DIHYDROINDOLIZINONE DERIVATIVE 第一三共株式会社 2019-07-25 WO 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-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 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 (3 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-11530211-B2 Dihydroindolizinone derivative INSR, GPR119, IAPP ALDH1A1 55/4885MEN1 1938/4885KMT2A 2004/4885
US-20220339260-A1 METHOD FOR PRODUCING INSULIN-PRODUCING CELL USING DIHYDROINDOLIZINONE DERIVATIVES IAPP, INSR, GPR119 ALDH1A1 422/4885MEN1 2467/4885KMT2A 2395/4885
US-20210053965-A1 DIHYDROINDOLIZINONE DERIVATIVE INSR, GPR119, IAPP ALDH1A1 55/4885MEN1 1938/4885KMT2A 2004/4885

“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.