SCHEMBL3435955

SCHEMBL3435955

COc1cc(Cl)ccc1-c1cc(C(=O)O)n(C(C)C)n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.43
HTT P42858 3/20 0.42
USP2 O75604 1/20 0.42
KMT2A Q03164 1/20 0.42
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.39
CTSA P10619 1/20 0.39
GRM5 P41594 1/20 0.39
MARS1 P56192 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
CRHR1 P34998 2/20 0.38
ALPL P05186 1/20 0.38
CCR2 P41597 1/20 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
SCHEMBL3436592 0.84 CYP1A2 (0.44) CNR1HTTUSP2KMT2AHSP90AA1
SCHEMBL3435989 0.81 MARS1 (0.46) HTTUSP2KMT2AHSP90AA1HSP90AB1
SCHEMBL19936640 0.78 HSP90AA1 (0.43) CNR1HSP90AA1HSP90AB1ALDH1A1HPGD
SCHEMBL17593064 0.70 PHGDH (0.50) KMT2AALDH1A1
SCHEMBL3435547 0.69 ALPL (0.74) KMT2AHPGDMARS1ALPL
SCHEMBL10049127 0.69 KMT2A (0.45) CNR1HTTUSP2KMT2AALDH1A1
SCHEMBL10049034 0.69 ALDH1A1 (0.50) KMT2AHSP90AA1HSP90AB1ALDH1A1HPGD
SCHEMBL3434180 0.69 ALPL (0.59) CNR1HTTUSP2KMT2AALDH1A1
SCHEMBL14800212 0.69 MEN1 (0.47) KMT2AALDH1A1HPGDCTSAGRM5
SCHEMBL3435623 0.68 MARS1 (0.53) ALDH1A1HPGDMARS1

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 7 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

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 CNR1 3986/4885HTT 2731/4885USP2 1343/4885

“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.