SCHEMBL770476

SCHEMBL770476

O=C(CNC(=S)NC1CCCC1)N1CCC2CCCC=C2C1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 3/20 0.35
PKM P14618 2/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
EPHX1 P07099 1/20 0.35
ALOX12 P18054 2/20 0.34
KMT2A Q03164 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
SCHEMBL771342 0.99 ALDH1A1 (0.40) ALDH1A1MAPTTDP1LMNAPKM
SCHEMBL15380799 0.88 EPHX1 (0.46) ALDH1A1MAPTTDP1NPC1RAB9A
SCHEMBL771006 0.88 EPHX1 (0.46) ALDH1A1MAPTTDP1NPC1RAB9A
SCHEMBL772452 0.86 KMT2A (0.40) LMNAPKMNPC1RAB9ASMN1; SMN2
SCHEMBL771786 0.86 KMT2A (0.41) LMNAPKMNPC1RAB9ASMN1; SMN2
SCHEMBL771410 0.85 ALDH1A1 (0.35) ALDH1A1MAPTTDP1SMN1; SMN2EPHX1
SCHEMBL770590 0.83 HTT (0.37) ALDH1A1LMNARAB9AKMT2A
SCHEMBL15378203 0.81 EPHX2 (0.40) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL772432 0.80 ALDH1A1 (0.46) ALDH1A1MAPTLMNAPKMNPC1
SCHEMBL770629 0.79 TACR1 (0.38) ALDH1A1MAPTTDP1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822452-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2014-09-02 US disclosed
US-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2013-11-14 US 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 (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-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ALDH1A1 144/4885MAPT 618/4885TDP1 135/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ALDH1A1 142/4885MAPT 638/4885TDP1 134/4885

“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.