SCHEMBL3436680

SCHEMBL3436680

CCCn1cnc2cc(C(=O)O)ccc21

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 6/20 0.58
HPGD P15428 3/20 0.57
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
HDAC1 Q13547 1/20 0.55
PLA2G4A P47712 1/20 0.54
FGFR1 P11362 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.52
TP53 P04637 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL30138443 1.00 HCAR3 (0.58) HCAR3HPGDALDH1A1LMNAHDAC1
SCHEMBL30930540 0.92 HPGD (0.68) HCAR3HPGDALDH1A1LMNAPLA2G4A
SCHEMBL2361153 0.90 HPGD (0.63) HCAR3HPGDALDH1A1LMNAPLA2G4A
SCHEMBL6112850 0.88 HPGD (0.57) HCAR3HPGDALDH1A1LMNAHDAC1
SCHEMBL2996553 0.88 HCAR3 (0.60) HCAR3HPGDALDH1A1LMNAHDAC1
SCHEMBL22160858 0.87 HPGD (0.56) HPGDALDH1A1HDAC1FGFR1SMN1; SMN2
SCHEMBL31183038 0.87 HCAR3 (0.55) HCAR3HPGDALDH1A1LMNAHDAC1
SCHEMBL6805679 0.86 HDAC1 (0.56) HCAR3HPGDALDH1A1LMNAHDAC1
SCHEMBL3816420 0.85 HCAR3 (0.54) HCAR3HPGDALDH1A1LMNAPLA2G4A
SCHEMBL5768114 0.85 HDAC1 (0.55) HCAR3HPGDALDH1A1LMNAHDAC1

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 8 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
EP-2594555-A1 HETEROCYCLIC COMPOUND, AND p27 KIP1 DEGRADATION INHIBITOR ASKA Pharmaceutical Co., Ltd. (JP) 2013-05-22 EP 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
WO-2010126922-A1 BENZIMIDAZOLECARBOXAMIDES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC (US) 2010-11-04 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 3795/4885HPGD 1130/4885ALDH1A1 1594/4885

“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.