SCHEMBL770381

SCHEMBL770381

O=C(O)CCCC(=O)N1CCC2CCCC=C2C1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 5/20 0.41
ITGA2B P08514 5/20 0.41
NPC1 O15118 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 3/20 0.37
MAPK1 P28482 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.37
KDM4E B2RXH2 1/20 0.36
TSHR P16473 1/20 0.36
EPHX1 P07099 2/20 0.36
EPHX2 P34913 2/20 0.36
ENPP2 Q13822 3/20 0.36
POLB P06746 1/20 0.34

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
SCHEMBL770768 0.97 ITGB3 (0.41) ITGB3ITGA2BNPC1SMN1; SMN2ALDH1A1
SCHEMBL769789 0.95 NPC1 (0.42) ITGB3ITGA2BNPC1SMN1; SMN2ALDH1A1
SCHEMBL770696 0.92 MEN1 (0.38) ITGB3ITGA2BSMN1; SMN2ALDH1A1MAPK1
SCHEMBL770401 0.92 LMNA (0.39) NPC1SMN1; SMN2ALDH1A1MAPK1LMNA
SCHEMBL770997 0.90 ATM (0.47) NPC1SMN1; SMN2ALDH1A1HPGDHTT
SCHEMBL771656 0.89 MAPK1 (0.36) NPC1SMN1; SMN2ALDH1A1MAPK1LMNA
SCHEMBL770204 0.88 HDAC3 (0.42) NPC1SMN1; SMN2ALDH1A1MAPK1LMNA
SCHEMBL769712 0.87 NPC1 (0.57) NPC1SMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL771398 0.87 SMYD3 (0.36) ITGB3ITGA2BNPC1SMN1; SMN2ALDH1A1
SCHEMBL771969 0.87 KMT2A (0.44) NPC1SMN1; SMN2ALDH1A1HPGDHTT

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
EP-2439202-B1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 SALVAT LAB SA (ES) 2016-04-20 EP disclosed
US-8524894-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2013-09-03 US disclosed
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2012-03-22 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-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ITGB3 4856/4885ITGA2B 4849/4885NPC1 104/4885

“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.