SCHEMBL18699424

SCHEMBL18699424

NNCN/C1=C/CCCCCC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.36
ALOX15 P16050 1/20 0.36
TAAR1 Q96RJ0 1/20 0.31
CTSK P43235 1/20 0.31
KDM1A O60341 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
SCHEMBL24467125 0.82 ALOX15 (0.37) SMN1; SMN2ALOX15CTSK
Hydrochloric Acid SCHEMBL8467904 0.78 ALOX15 (0.37) SMN1; SMN2ALOX15KDM1A
Hydrochloric Acid SCHEMBL8469215 0.78 ALOX15 (0.37) SMN1; SMN2ALOX15KDM1A
SCHEMBL18411281 0.76 ALOX15 (0.39) SMN1; SMN2ALOX15KDM1A
SCHEMBL1485782 0.75 ALOX15 (0.38) SMN1; SMN2ALOX15CTSK
SCHEMBL1485781 0.75 ALOX15 (0.38) SMN1; SMN2ALOX15CTSK
SCHEMBL24087422 0.75 ALOX15 (0.38) SMN1; SMN2ALOX15CTSK
Hydrochloric Acid SCHEMBL8461802 0.75 ALOX15 (0.34) SMN1; SMN2ALOX15KDM1A
SCHEMBL25477987 0.74 HDAC4 (0.32) SMN1; SMN2ALOX15CTSK
SCHEMBL368190 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180212160-A1 LUMINESCENT PALLADIUM(0) AND PLATINUM(0) CARBENE COMPLEXES FOR OLEDS UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2018-07-26 US disclosed
EP-2970207-B1 SUBSTITUTED PIPERIDINE COMPOUNDS AND THEIR USE AS OREXIN RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-16 EP disclosed
US-9695183-B2 Substituted 7-azabicycles and their use as orexin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2017-07-04 US disclosed
US-9611262-B2 Substituted 2-azabicycles and their use as orexin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2017-04-04 US disclosed
US-9611277-B2 Substituted 2-azabicycles and their use as orexin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2017-04-04 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-20180212160-A1 LUMINESCENT PALLADIUM(0) AND PLATINUM(0) CARBENE COMPLEXES FOR OLEDS ZC3HAV1L, OCIAD1, ZKSCAN2 SMN1; SMN2 3116/4885ALOX15 532/4885TAAR1 3247/4885

“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.