SCHEMBL3598973

SCHEMBL3598973

CCOC(=O)c1cccc(NCC=C(C)CCC=C(C)C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.50
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
LMNA P02545 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TRPV1 Q8NER1 3/20 0.49
KMT2A Q03164 3/20 0.48
MAPT P10636 3/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
NPSR1 Q6W5P4 2/20 0.47
POLB P06746 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
PKM P14618 1/20 0.46
CDC25B P30305 1/20 0.46
MAPK1 P28482 1/20 0.45

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
SCHEMBL3793148 0.90 TRPV1 (0.51) RAB9ANPC1TRPV1MAPTALDH1A1
SCHEMBL3598188 0.90 TRPV1 (0.51) RAB9ANPC1TRPV1MAPTALDH1A1
SCHEMBL8222368 0.88 TRPV1 (0.50) RAB9ANPC1TRPV1MAPTALDH1A1
SCHEMBL3600241 0.84 TRPV1 (0.53) LMNATRPV1KMT2AMAPTMEN1
SCHEMBL3600239 0.84 TRPV1 (0.53) LMNATRPV1KMT2AMAPTMEN1
SCHEMBL8224018 0.83 TRPV1 (0.52) SMN1; SMN2RAB9ANPC1LMNATRPV1
SCHEMBL12802069 0.80 TRPV1 (0.46) TRPV1MAPTPOLB
SCHEMBL6576790 0.79 TRPV1 (0.42) SMN1; SMN2LMNATRPV1
SCHEMBL6576794 0.79 TRPV1 (0.42) SMN1; SMN2LMNATRPV1
SCHEMBL3593347 0.79 TRPV1 (0.51) TRPV1KMT2AMAPTCYP1A2CYP2C9

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-20100041665-A1 N-PHENYL-PRENYLAMINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA, S.A. (ES) 2010-02-18 US disclosed
EP-2057114-A1 N-PHENYL-PRENYLAMINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA, S.A. (ES) 2009-05-13 EP disclosed
WO-2008015240-A1 N-PHENYL-PRENYLAMINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS NOSCIRA, S.A. (ES) 2008-02-07 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-20100041665-A1 N-PHENYL-PRENYLAMINE DERIVATIVES FOR THE TREATMENT OF COGNITIVE, NEURODEGENERATIVE OR NEURONAL DISEASES OR DISORDERS PNMT, PSEN1, SNCA SMN1; SMN2 108/4885RAB9A 372/4885NPC1 17/4885

“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.