SCHEMBL3437994

SCHEMBL3437994

CC(C)n1cnc2cc(CO)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 1/20 0.57
RAB9A P51151 8/20 0.56
NPC1 O15118 7/20 0.56
KDM4E B2RXH2 5/20 0.56
GFER P55789 2/20 0.49
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
ALDH1A1 P00352 4/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HPGD P15428 3/20 0.45
TP53 P04637 2/20 0.43
HSD17B10 Q99714 3/20 0.42
IDE P14735 1/20 0.42
P2RX3 P56373 1/20 0.40
S1PR1 P21453 1/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37

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
SCHEMBL22185867 0.85 RAB9A (0.57) HCAR3RAB9ANPC1KDM4EGFER
SCHEMBL19553943 0.84 RAB9A (0.56) HCAR3RAB9ANPC1KDM4EGFER
SCHEMBL20932206 0.84 RAB9A (0.56) HCAR3RAB9ANPC1KDM4EGFER
SCHEMBL23949542 0.84 RAB9A (0.56) HCAR3RAB9ANPC1KDM4EGFER
SCHEMBL22299570 0.81 RAB9A (0.53) HCAR3RAB9ANPC1KDM4EGFER
SCHEMBL12730480 0.78 HCAR3 (0.62) HCAR3RAB9ANPC1KDM4EGFER
SCHEMBL541672 0.78 NPC1 (0.52) RAB9ANPC1KDM4EGFERMAPT
SCHEMBL11396992 0.76 RAB9A (0.61) HCAR3RAB9ANPC1KDM4EGFER
SCHEMBL3437990 0.75 NPC1 (0.56) RAB9ANPC1KDM4EGFERMAPT
SCHEMBL20665086 0.75 HCAR3 (0.58) HCAR3RAB9ANPC1KDM4EGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2594555-B1 HETEROCYCLIC COMPOUND, AND p27 KIP1 DEGRADATION INHIBITOR ASKA PHARM CO LTD (JP) 2018-03-07 EP disclosed
US-9200008-B2 Heterocyclic compound and p27Kip1 degradation inhibitor ASKA PHARMACEUTICAL CO., LTD. (JP) 2015-12-01 US disclosed
US-9200008-B2 Heterocyclic compound and p27Kip1 degradation inhibitor ASKA PHARMACEUTICAL CO., LTD. (JP) 2015-12-01 US disclosed
US-20130079306-A1 HETEROCYCLIC COMPOUND AND p27Kip1 DEGRADATION INHIBITOR ASKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-28 US disclosed
US-20130079306-A1 HETEROCYCLIC COMPOUND AND p27Kip1 DEGRADATION INHIBITOR ASKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-28 US disclosed
WO-2012002527-A1 HETEROCYCLIC COMPOUND, AND p27 KIP1 DEGRADATION INHIBITOR あすか製薬株式会社 (JP) 2012-01-05 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-20130079306-A1 HETEROCYCLIC COMPOUND AND p27Kip1 DEGRADATION INHIBITOR CDKN1A, SKP2, CCNI HCAR3 3795/4885RAB9A 2990/4885NPC1 3743/4885

“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.