SCHEMBL16240667

SCHEMBL16240667

CCc1ccc(/C=C(/N=[N+]=[N-])C(=O)OC)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
AKR1C3 P42330 1/20 0.36
NPC1 O15118 2/20 0.35
GFER P55789 1/20 0.35
MAOA P21397 1/20 0.35
PLK1 P53350 1/20 0.34
SRC P12931 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
MAOB P27338 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL16240668 1.00 RAB9A (0.36) RAB9AALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL14101130 0.84 MAPT (0.42) RAB9AALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL14337625 0.82 MEN1 (0.41) MAPTAKR1C3KMT2A
SCHEMBL27891903 0.82 KDM4E (0.56) RAB9AALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL27908831 0.81 APP (0.46) RAB9AALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL18299800 0.80 PDE2A (0.41) RAB9ANPC1KMT2AGAA
SCHEMBL18299803 0.80 PDE2A (0.41) RAB9ANPC1KMT2AGAA
SCHEMBL18299799 0.80 PDE2A (0.41) RAB9ANPC1KMT2AGAA
SCHEMBL23045576 0.80 SMN1; SMN2 (0.44) RAB9AALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL23045575 0.80 SMN1; SMN2 (0.44) RAB9AALDH1A1MAPTSMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9233921-B2 Potent poxvirus inhibitor THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-01-12 US disclosed
US-20140343114-A1 Potent poxvirus inhibitor THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2014-11-20 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-20140343114-A1 Potent poxvirus inhibitor MAVS, VAC14, GZMB RAB9A 3228/4885ALDH1A1 3744/4885MAPT 3078/4885

“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.