SCHEMBL14675951

SCHEMBL14675951

O=C(c1ccnc(Cl)c1)N1CC2(CCNCC2)c2cc(Sc3ccc(F)cc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.36
AKT1 P31749 2/20 0.35
NOTUM Q6P988 1/20 0.35
MAPK14 Q16539 5/20 0.33
MAPK11 Q15759 4/20 0.33
HTR2C P28335 1/20 0.33
HTR6 P50406 1/20 0.33
MAPKAPK2 P49137 1/20 0.33
PROKR1 Q8TCW9 2/20 0.32
MGLL Q99685 1/20 0.31

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
SCHEMBL14683175 0.89 PDE4B (0.36) PDE4BAKT1NOTUMMAPK14MAPK11
Hydrochloric Acid SCHEMBL2351254 0.89 AKT1 (0.42) PDE4BAKT1NOTUMPROKR1
SCHEMBL14683184 0.88 NOTUM (0.36) PDE4BAKT1NOTUMMAPK14MAPK11
SCHEMBL1689732 0.84 NOTUM (0.51) AKT1NOTUMPROKR1
SCHEMBL14683188 0.82 SMN1; SMN2 (0.36)
SCHEMBL15772145 0.82 SMN1; SMN2 (0.36)
SCHEMBL10253494 0.81 NOTUM (0.44) PDE4BAKT1NOTUM
SCHEMBL15772672 0.80 SMN1; SMN2 (0.41)
SCHEMBL15771957 0.80 DRD2 (0.35) NOTUMPROKR1
SCHEMBL14683218 0.80 SMN1; SMN2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2739626-B1 NOVEL SPIROINDOLINE COMPOUNDS INTERVET INT BV (NL) 2016-05-04 EP disclosed
US-9096599-B2 Spiroindoline compounds INTERVET INC. (US) 2015-08-04 US disclosed
US-20140163056-A1 NOVEL SPIROINDOLINE COMPOUNDS INTERVET INC. 2014-06-12 US disclosed
EP-2739626-A1 NOVEL SPIROINDOLINE COMPOUNDS Intervet International B.V. (NL) 2014-06-11 EP disclosed
WO-2013017678-A1 NOVEL SPIROINDOLINE COMPOUNDS INTERVET INTERNATIONAL B.V. (NL) 2013-02-07 WO disclosed
WO-2013017678-A1 NOVEL SPIROINDOLINE COMPOUNDS INTERVET INTERNATIONAL B.V. (NL) 2013-02-07 WO 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-20140163056-A1 NOVEL SPIROINDOLINE COMPOUNDS PKD2, PKD1, REN PDE4B 218/4885AKT1 3154/4885NOTUM 1914/4885

“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.