SCHEMBL13762167

SCHEMBL13762167

CCCCN(CCC)C(=O)Cc1c(C(=O)C(C)(C)C)oc2ccc(CO)cc12

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 2/20 0.36
TP53 P04637 2/20 0.36
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TSPO P30536 1/20 0.34
MAPT P10636 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.33

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
SCHEMBL13762157 0.98 LMNA (0.37) POLBAPEX1TDP1LMNATP53
SCHEMBL13762163 0.96 POLB (0.40) POLBAPEX1TDP1TSPOMAPT
SCHEMBL13762284 0.94 CYP1A2 (0.36) LMNATP53ALDH1A1SMN1; SMN2MAPT
SCHEMBL13762198 0.89 LMNA (0.38) TDP1LMNATP53ALDH1A1SMN1; SMN2
SCHEMBL13762156 0.87 MLYCD (0.38) POLBAPEX1TDP1LMNAALDH1A1
SCHEMBL4193769 0.85 MEN1 (0.42) POLBLMNATP53ALDH1A1SMN1; SMN2
SCHEMBL13762382 0.85 KDM4E (0.38) LMNAALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL14012536 0.84 MEN1 (0.35) LMNASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL4195268 0.83 KDM4E (0.43) POLBLMNATP53ALDH1A1SMN1; SMN2
SCHEMBL13762283 0.82 ALDH1A1 (0.37) LMNAALDH1A1SMN1; SMN2MAPTKDM4E

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-7576122-B2 Ophthalmic compositions for treating ocular hypertension MERCK & CO. INC. (US) 2009-08-18 US disclosed
US-20080287489-A1 Ophthalmic compositions for treating ocular hypertension MERCK SHARP & DOHME CORP. 2008-11-20 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-20080287489-A1 Ophthalmic compositions for treating ocular hypertension KCNH2, KCNH3, KCNJ11 POLB 3761/4885APEX1 3800/4885TDP1 2742/4885

“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.