SCHEMBL14699472

SCHEMBL14699472

COC(=O)c1ccc(N=NN2CCN(c3ccc(F)cc3)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.65
NPC1 O15118 8/20 0.65
SMN1; SMN2 Q16637 4/20 0.65
MAPT P10636 10/20 0.64
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 3/20 0.49
TP53 P04637 2/20 0.48
LMNA P02545 1/20 0.48
CYP1A1 P04798 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPK1 P28482 2/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
NPSR1 Q6W5P4 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
SCHEMBL14699470 1.00 RAB9A (0.65) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14697548 0.89 RAB9A (0.67) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14697547 0.89 RAB9A (0.67) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14697973 0.88 SMN1; SMN2 (0.65) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14698163 0.88 SMN1; SMN2 (0.65) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14697529 0.88 RAB9A (0.68) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14698159 0.88 RAB9A (0.68) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14698025 0.79 MAPT (0.45) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14698026 0.79 MAPT (0.45) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL14709064 0.78 RAB9A (0.76) RAB9ANPC1SMN1; SMN2MAPTALDH1A1

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-9273018-B2 Piperazine derivatives ST. MARY'S UNIVERSITY (CA) 2016-03-01 US claimed
US-20140309196-A1 PIPERAZINE DERIVATIVES ST. MARY'S UNIVERSITY (CA) 2014-10-16 US claimed
WO-2013023273-A1 PIPERAZINE DERIVATIVES ST. MARY'S UNIVERSITY (CA) 2013-02-21 WO claimed
US-9273018-B2 Piperazine derivatives ST. MARY'S UNIVERSITY (CA) 2016-03-01 US disclosed
US-20140309196-A1 PIPERAZINE DERIVATIVES ST. MARY'S UNIVERSITY (CA) 2014-10-16 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-20140309196-A1 PIPERAZINE DERIVATIVES TP53, EP300, GOT2 RAB9A 2420/4885NPC1 79/4885SMN1; SMN2 947/4885

“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.