SCHEMBL12459709

SCHEMBL12459709

O=C(c1ccnc(Cl)c1)N1CC2(CCN(C/C=C/c3ccc(F)c(F)c3)CC2)c2cc(F)ccc21

nearest known ligand 0.89

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
PDE4B Q07343 7/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
PLA2G1B P04054 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
NOTUM Q6P988 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
SCHEMBL13837491 1.00 SMN1; SMN2 (0.35) SMN1; SMN2PDE4BHDAC1HDAC6PLA2G1B
SCHEMBL895333 0.94 SMN1; SMN2 (0.38) SMN1; SMN2HDAC1HDAC6PLA2G1BATG4B
SCHEMBL29368845 0.94 SMN1; SMN2 (0.38) SMN1; SMN2HDAC1HDAC6PLA2G1BATG4B
SCHEMBL12459700 0.94 NOTUM (0.40) SMN1; SMN2PDE4BHDAC1HDAC6NOTUM
SCHEMBL895335 0.94 SMN1; SMN2 (0.38) SMN1; SMN2HDAC1HDAC6PLA2G1BATG4B
SCHEMBL12459608 0.92 SMN1; SMN2 (0.39) SMN1; SMN2HDAC1HDAC6
SCHEMBL12459607 0.92 SMN1; SMN2 (0.36) SMN1; SMN2PDE4BHDAC1HDAC6PLA2G1B
SCHEMBL14675298 0.92 SMN1; SMN2 (0.33) SMN1; SMN2PDE4BHDAC1HDAC6PLA2G1B
SCHEMBL14675297 0.92 SMN1; SMN2 (0.33) SMN1; SMN2PDE4BHDAC1HDAC6PLA2G1B
SCHEMBL12459710 0.91 SMN1; SMN2 (0.37) SMN1; SMN2HDAC1HDAC6PLA2G1BATG4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9598412-B2 Spiroindoline compounds for use as anthelminthics INTERVET INC. (US) 2017-03-21 US disclosed
US-20150057302-A1 SPIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHICS INTERVET INC. 2015-02-26 US disclosed
US-20150057302-A1 SPIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHICS INTERVET INC. 2015-02-26 US disclosed
US-20150057302-A1 SPIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHICS INTERVET INC. 2015-02-26 US disclosed
EP-2531506-B1 Spiroindoline compounds for use as anthelminthics INTERVET INT BV (NL) 2014-05-14 EP disclosed
US-20120295931-A1 SPIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHICS INTERVET INC. 2012-11-22 US disclosed
US-20120295931-A1 SPIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHICS INTERVET INC. 2012-11-22 US disclosed
US-20120295931-A1 SPIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHICS INTERVET INC. 2012-11-22 US disclosed
WO-2011095581-A1 S PIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHI CS INTERVET INTERNATIONAL B.V. (NL) 2011-08-11 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 (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-20150057302-A1 SPIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHICS PKD2, PKD1, PIR SMN1; SMN2 3833/4885PDE4B 426/4885HDAC1 607/4885
US-20120295931-A1 SPIROINDOLINE COMPOUNDS FOR USE AS ANTHELMINTHICS PKD2, PKD1, PIR SMN1; SMN2 3833/4885PDE4B 426/4885HDAC1 607/4885

“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.