SCHEMBL4833474

SCHEMBL4833474

CC(C)(C)OC(=O)CCCOc1cccc(Br)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
KMT2A Q03164 2/20 0.53
MAPT P10636 1/20 0.53
KDM4E B2RXH2 10/20 0.52
LMNA P02545 2/20 0.52
RAB9A P51151 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 1/20 0.47
GAA P10253 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.45
HSD17B10 Q99714 1/20 0.43
MRGPRX4 Q96LA9 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
SCHEMBL4844769 0.93 KDM4E (0.53) ALDH1A1KMT2AMAPTKDM4ELMNA
SCHEMBL21577271 0.86 CHRNB2 (0.51)
SCHEMBL13986556 0.84 SMN1; SMN2 (0.58) ALDH1A1KMT2AMAPTLMNARAB9A
SCHEMBL12272227 0.84 KDM4E (0.59) ALDH1A1KMT2AMAPTKDM4ELMNA
SCHEMBL29976920 0.84 KDM4E (0.59) ALDH1A1KMT2AMAPTKDM4ELMNA
SCHEMBL7110609 0.84 HSD17B10 (0.52) ALDH1A1KMT2AMAPTKDM4ELMNA
SCHEMBL29103165 0.82 ALDH1A1 (0.52) ALDH1A1KMT2AMAPTKDM4ELMNA
SCHEMBL15110304 0.82 KMT2A (0.61) KMT2ARAB9APOLB
SCHEMBL30856532 0.82 KMT2A (0.61) KMT2ARAB9APOLB
SCHEMBL16673260 0.82 L3MBTL1 (0.52) ALDH1A1KMT2ALMNARAB9ATDP1

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 3 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

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 ALDH1A1 1819/4885KMT2A 1435/4885MAPT 763/4885

“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.