SCHEMBL1633342

SCHEMBL1633342

CCCC1(C(=O)OCC)CCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
MAPK1 P28482 1/20 0.40
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
POLB P06746 4/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
PKM P14618 1/20 0.39
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ATM Q13315 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
SCHEMBL8071102 0.89 CYP4F2 (0.45) SMN1; SMN2MAPK1MEN1KMT2ACYP4F2
SCHEMBL29210884 0.86 CYP4F2 (0.46) SMN1; SMN2MAPK1MEN1KMT2ACYP4F2
SCHEMBL1659167 0.85 SMN1; SMN2 (0.40) SMN1; SMN2MAPK1MEN1KMT2ACYP4F2
SCHEMBL11345271 0.85 CYP4F2 (0.49) MAPK1MEN1KMT2ACYP4F2CYP4A11
SCHEMBL2289682 0.83 SMN1; SMN2 (0.44) SMN1; SMN2MAPK1MEN1KMT2APOLB
SCHEMBL24242177 0.83 TSHR (0.41) MAPK1MEN1KMT2APOLBMAPT
SCHEMBL13269452 0.83 OPRM1 (0.49) MAPK1MEN1KMT2APOLBMAPT
SCHEMBL21399965 0.83 CYP4F2 (0.47) MAPK1MEN1KMT2ACYP4F2CYP4A11
SCHEMBL6060809 0.82 CYP4F2 (0.50) SMN1; SMN2MAPK1MEN1KMT2ACYP4F2
SCHEMBL22098179 0.82 CYP4F2 (0.63) SMN1; SMN2MAPK1MEN1KMT2ACYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932420-B2 Lowering intraocular pressure; glaucoma ALLERGAN, INC. (US) 2011-04-26 US disclosed
US-7932420-B2 Lowering intraocular pressure; glaucoma ALLERGAN, INC. (US) 2011-04-26 US disclosed
US-20080167331-A1 Novel sulfonamides BURK ROBERT M 2008-07-10 US disclosed
US-20080167331-A1 Novel sulfonamides BURK ROBERT M 2008-07-10 US disclosed
EP-1919862-A2 NOVEL SULFONAMIDES ALLERGAN, INC. (US) 2008-05-14 EP disclosed
US-7314890-B2 Sulfonamides ALLERGAN, INC. (US) 2008-01-01 US disclosed
US-7314890-B2 Sulfonamides ALLERGAN, INC. (US) 2008-01-01 US disclosed
WO-2007024611-A2 SULFONAMIDES OF 7 -AMINOHEPTANOIC ACID DERIVATIVES FOR TREATING GLAUCOMA ALLERGAN, INC. (US) 2007-03-01 WO disclosed
US-20070043090-A1 Novel Sulfonamides ALLERGAN, INC. 2007-02-22 US disclosed
US-20070043090-A1 Novel Sulfonamides ALLERGAN, INC. 2007-02-22 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 (2 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-20080167331-A1 Novel sulfonamides NR2E3, NR5A2, HRH4 SMN1; SMN2 993/4885MAPK1 3665/4885MEN1 1714/4885
US-20070043090-A1 Novel Sulfonamides NR2E3, NR5A2, HRH4 SMN1; SMN2 993/4885MAPK1 3665/4885MEN1 1714/4885

“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.