SCHEMBL29384705

SCHEMBL29384705

O=C(NCC(=O)N1CCC(Nc2ccccc2C(F)(F)F)CC1)c1cc(-c2ccccc2)on1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD5 Q86SK9 4/20 0.53
SCD O00767 2/20 0.53
NPC1 O15118 5/20 0.52
RAB9A P51151 5/20 0.52
KMT2A Q03164 4/20 0.52
MAPT P10636 2/20 0.52
MEN1 O00255 1/20 0.52
XBP1 P17861 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
ALDH1A1 P00352 1/20 0.51
HIF1A Q16665 3/20 0.49
TP53 P04637 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
USP30 Q70CQ3 1/20 0.45
S1PR1 P21453 1/20 0.45
POLB P06746 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL68730 1.00 SCD5 (0.53) SCD5SCDNPC1RAB9AKMT2A
SCHEMBL29385678 0.86 HIF1A (0.52) SCD5NPC1RAB9AKMT2AHIF1A
SCHEMBL69338 0.86 HIF1A (0.52) SCD5NPC1RAB9AKMT2AHIF1A
SCHEMBL29385107 0.86 HIF1A (0.52) SCD5NPC1RAB9AKMT2AHIF1A
SCHEMBL69860 0.86 HIF1A (0.52) SCD5NPC1RAB9AKMT2AHIF1A
SCHEMBL1222168 0.84 SCD5 (0.54) SCD5SCDNPC1RAB9AKMT2A
SCHEMBL69191 0.83 SCD5 (0.52) SCD5NPC1RAB9AKMT2AMAPT
SCHEMBL29385676 0.83 SCD5 (0.52) SCD5NPC1RAB9AKMT2AMAPT
SCHEMBL29381924 0.82 SCD (0.56) SCDNPC1RAB9AKMT2AMEN1
SCHEMBL69750 0.82 SCD (0.56) SCDNPC1RAB9AKMT2AMEN1

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
US-12433880-B2 Methods for the treatment of neurological disorders JANSSEN PHARMACEUTICA NV (BE) 2025-10-07 US disclosed
EP-3566055-B1 SCD INHIBITOR FOR THE TREATMENT OF NEUROLOGICAL DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2025-03-12 EP disclosed
US-20220040167-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2022-02-10 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-12433880-B2 Methods for the treatment of neurological disorders NLN, CLN6, OTC SCD5 1591/4885SCD 1194/4885NPC1 356/4885
US-20220040167-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS NLN, CLN6, OTC SCD5 1591/4885SCD 1194/4885NPC1 356/4885

“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.