SCHEMBL20695210

SCHEMBL20695210

O=C1CCC2(CN(C(=O)c3ccc(-c4ccccc4)cc3)C2)N1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 4/20 0.50
▸ HPGD P15428 1/20 0.50
▸ FASN P49327 5/20 0.49
▸ POLB P06746 2/20 0.47
▸ SLC6A7 Q99884 3/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ GHSR Q92847 2/20 0.45
▸ TSHR P16473 4/20 0.45
▸ LMNA P02545 2/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ DDB1 Q16531 2/20 0.43
▸ CRBN Q96SW2 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ USP2 O75604 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ TP53 P04637 1/20 0.42

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
SCHEMBL20695340 0.88 BRD4 (0.50) MAPK1HPGDSLC6A7MEN1KMT2A
SCHEMBL20695153 0.88 SLC6A7 (0.42) HPGDPOLBSLC6A7ALDH1A1SMN1; SMN2
SCHEMBL20695155 0.87 SLC6A7 (0.49) SLC6A7
SCHEMBL20695446 0.85 HPGD (0.47) HPGDMEN1KMT2AALDH1A1CRBN
SCHEMBL20695169 0.85 MEN1 (0.47) HPGDSLC6A7MEN1KMT2ATSHR
SCHEMBL20695461 0.85 TTR (0.44) DDB1CRBN
SCHEMBL20695299 0.84 GHSR (0.44) MAPK1HPGDFASNPOLBGHSR
SCHEMBL20695167 0.84 MGLL (0.39) MAPK1HPGDFASNALDH1A1CRBN
SCHEMBL20695238 0.84 CRBN (0.39) HPGDMEN1KMT2ATSHRDDB1
SCHEMBL20708883 0.83 MAPK1 (0.49) MAPK1HPGDFASNPOLBSLC6A7

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 MAPK1 308/4885HPGD 509/4885FASN 3889/4885
US-10610520-B2 Heterocyclic compound MAG, HTT, ACHE MAPK1 308/4885HPGD 509/4885FASN 3889/4885

“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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