SCHEMBL4841346

SCHEMBL4841346

CCOC(=O)CCSc1ccc(C#N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
BRCA1 P38398 1/20 0.46
PKM P14618 1/20 0.46
HTT P42858 1/20 0.46
MAOA P21397 2/20 0.45
MAOB P27338 2/20 0.45
MAPT P10636 7/20 0.45
ALDH1A1 P00352 5/20 0.45
HPGD P15428 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
POLB P06746 2/20 0.43
KDM4E B2RXH2 2/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
GLA P06280 1/20 0.41
MAPK1 P28482 2/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL3838084 0.85 ALDH1A1 (0.49) KMT2AMEN1MAOAMAOBMAPT
SCHEMBL13948873 0.83 ALDH1A1 (0.61) KMT2AMEN1PKMHTTMAPT
SCHEMBL25270599 0.80 MAPT (0.55) KMT2AMEN1PKMHTTMAPT
SCHEMBL7651344 0.80 HSP90AA1 (0.51) KMT2AMEN1PKMHTTMAPT
SCHEMBL28932704 0.80 HTT (0.68) KMT2AMEN1PKMHTTMAPT
SCHEMBL6137137 0.80 MAPT (0.48) KMT2AMEN1PKMHTTMAPT
SCHEMBL2958789 0.80 KMT2A (0.50) KMT2AMEN1BRCA1MAPTALDH1A1
SCHEMBL7344673 0.80 ALDH1A1 (0.61) KMT2AMAPTALDH1A1HPGDL3MBTL1
SCHEMBL15970987 0.79 MMP2 (0.59) MAPTALDH1A1L3MBTL1POLBRAB9A
SCHEMBL6928975 0.79 ATM (0.57) PKMHTTMAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102746214-A Novel indoline compounds FOURNIER LAB SA 2012-10-24 CN disclosed
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 US disclosed
CN-101184731-A Indoline compounds FOURNIER LAB SA (FR) 2008-05-21 CN 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 KMT2A 1435/4885MEN1 2712/4885BRCA1 1092/4885

“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.