SCHEMBL20695446

SCHEMBL20695446

CC(C)(C)c1ccc(-c2ccc(C(=O)N3CC4(CCC(=O)N4)C3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.47
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ HTT P42858 2/20 0.47
▸ ALOX15 P16050 1/20 0.46
▸ ABL1 P00519 1/20 0.43
▸ BCR P11274 1/20 0.43
▸ MGLL Q99685 1/20 0.42
▸ MITF O75030 1/20 0.41
▸ HSD11B1 P28845 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ CRBN Q96SW2 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ TRPV1 Q8NER1 1/20 0.38
▸ FFAR2 O15552 1/20 0.38

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
SCHEMBL20695360 0.89 MGLL (0.49) HPGDMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL20695169 0.88 MEN1 (0.47) HPGDMEN1KMT2AMGLLHSD11B1
SCHEMBL20695210 0.85 MAPK1 (0.50) HPGDMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL20695153 0.84 SLC6A7 (0.42) HPGDALDH1A1SMN1; SMN2MGLL
SCHEMBL20695191 0.82 RXRA (0.46) HPGDMEN1KMT2ASMN1; SMN2MGLL
SCHEMBL20945342 0.80 MGLL (0.38) HPGDMEN1KMT2AMGLLCRBN
SCHEMBL20695388 0.80 HRH3 (0.46) MGLLHSD11B1CRBN
SCHEMBL20695167 0.80 MGLL (0.39) HPGDALDH1A1SMN1; SMN2MGLLCRBN
SCHEMBL20695238 0.80 CRBN (0.39) HPGDMEN1KMT2AMGLLHSD11B1
SCHEMBL20695420 0.79 HDAC6 (0.39) HPGDALDH1A1MGLLCRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10610520-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-04-07 — — US disclosed
US-20190125728-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-05-02 — — US disclosed
US-20190125728-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-05-02 — — US disclosed
EP-3438109-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2019-02-06 — — EP disclosed
EP-3438109-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2019-02-06 — — EP 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 (2 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-20190125728-A1 HETEROCYCLIC COMPOUND MAG, HTT, ACHE HPGD 509/4885MEN1 183/4885KMT2A 1317/4885
US-10610520-B2 Heterocyclic compound MAG, HTT, ACHE HPGD 509/4885MEN1 183/4885KMT2A 1317/4885

“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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