SCHEMBL4843719

SCHEMBL4843719

COC(=O)C(C)(C)COc1ccc(C#N)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.49
AR P10275 4/20 0.47
DGAT1 O75907 1/20 0.46
MMP2 P08253 5/20 0.45
MMP3 P08254 4/20 0.45
MMP1 P03956 1/20 0.44
MMP9 P14780 1/20 0.44
MMP13 P45452 1/20 0.44
RAB9A P51151 2/20 0.43
MGLL Q99685 1/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
PKM P14618 1/20 0.43
MAPK1 P28482 1/20 0.43
IL18 Q14116 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL10062799 0.86 AR (0.55) MAPTALDH1A1ARMMP2MMP3
SCHEMBL9935945 0.86 DGAT1 (0.55) ALDH1A1DGAT1KDM4E
SCHEMBL12117613 0.85 MAPT (0.47) MAPTALDH1A1ARMMP2MMP3
SCHEMBL3881117 0.83 DGAT1 (0.49) MAPTALDH1A1DGAT1KDM4ELMNA
SCHEMBL13948727 0.82 CYP2C9 (0.46) MAPTALDH1A1DGAT1RAB9AKMT2A
SCHEMBL8263994 0.81 ALDH1A1 (0.48) MAPTALDH1A1DGAT1RAB9AKMT2A
SCHEMBL21748570 0.81 SSTR4 (0.53) MAPTALDH1A1DGAT1RAB9AKMT2A
SCHEMBL21991531 0.81 SSTR4 (0.53) MAPTDGAT1KMT2AMEN1LMNA
SCHEMBL5367643 0.80 SSTR4 (0.51) MAPTDGAT1RAB9ALMNAPOLB
SCHEMBL16661237 0.80 DGAT1 (0.61) DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 MAPT 763/4885ALDH1A1 1819/4885AR 1477/4885

“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.