SCHEMBL3435514

SCHEMBL3435514

COc1cc(F)ccc1-c1nc(C)c(C(=O)O)s1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
KDM4E B2RXH2 4/20 0.48
RAB9A P51151 4/20 0.48
GAA P10253 1/20 0.48
NPC1 O15118 2/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 1/20 0.45
CTSA P10619 3/20 0.44
KMT2A Q03164 1/20 0.44
CCNT1 O60563 1/20 0.43
CDK9 P50750 1/20 0.43
CYP1A1 P04798 1/20 0.43
CYP1B1 Q16678 1/20 0.43
XDH P47989 1/20 0.42
TARBP2 Q15633 1/20 0.42
MAPT P10636 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
SCHEMBL3435518 0.87 SMN1; SMN2 (0.51) SMN1; SMN2KDM4ERAB9AGAANPC1
SCHEMBL3435042 0.87 KDM4E (0.57) SMN1; SMN2KDM4ERAB9AGAANPC1
SCHEMBL3436284 0.85 KDM4E (0.59) SMN1; SMN2KDM4ERAB9AGAANPC1
SCHEMBL3435973 0.84 CCNT1 (0.43) CTSACCNT1CDK9CYP1A1CYP1B1
SCHEMBL3436650 0.84 SMN1; SMN2 (0.54) SMN1; SMN2KDM4ERAB9AGAANPC1
SCHEMBL3435536 0.84 SMN1; SMN2 (0.54) SMN1; SMN2KDM4ERAB9AGAANPC1
SCHEMBL3436652 0.84 SMN1; SMN2 (0.61) SMN1; SMN2KDM4ERAB9AGAANPC1
SCHEMBL3436649 0.82 KDM4E (0.55) SMN1; SMN2KDM4ERAB9AGAANPC1
SCHEMBL14960177 0.79 CYP1A1 (0.43) KDM4EGAAALDH1A1KMT2ACYP1A1
SCHEMBL19936479 0.77 CYP1A1 (0.42) CYP1A1CYP1B1

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 SMN1; SMN2 2696/4885KDM4E 1069/4885RAB9A 2990/4885

“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.