SCHEMBL3436589

SCHEMBL3436589

CCn1nc(-c2ccc(Cl)cc2Cl)cc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MARS1 P56192 8/20 0.58
▸ MAPT P10636 1/20 0.49
▸ NPC1 O15118 2/20 0.48
▸ ALPL P05186 4/20 0.47
▸ HTT P42858 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ DHODH Q02127 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL1739252 0.85 ALPL (0.46) MARS1ALPLCNR1SMN1; SMN2
SCHEMBL3435989 0.85 MARS1 (0.46) MARS1MAPTNPC1HTT
SCHEMBL10049411 0.82 ALPL (0.54) MARS1NPC1ALPLDHODHKDM4E
SCHEMBL3436157 0.77 CA9 (0.48) MARS1MAPTNPC1ALPLKDM4E
SCHEMBL3436591 0.77 MARS1 (0.47) MARS1RAB9ASMN1; SMN2
SCHEMBL17593153 0.74 SMN1; SMN2 (0.56) MARS1MAPTHTTRAB9ASMN1; SMN2
SCHEMBL117660 0.73 MARS1 (1.00) MARS1NPC1SMN1; SMN2
SCHEMBL14800515 0.73 MAPT (0.50) MAPTNPC1ALPLHTTCNR1
SCHEMBL3435083 0.73 KMT2A (0.47) MAPTALPLHTTCNR1KDM4E
SCHEMBL4704508 0.73 GRN (0.43) MARS1MAPTNPC1HTTKDM4E

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 MARS1 2935/4885MAPT 4033/4885NPC1 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.

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