SCHEMBL29839311

SCHEMBL29839311

Cc1cn(-c2ccc(F)cc2OCC(F)(F)F)c(=O)c2c(C(=O)Nc3ccc(N4CCOCC4)cc3)cnn12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UGCG Q16739 3/20 0.51
▸ PDE10A Q9Y233 1/20 0.44
▸ AXL P30530 5/20 0.44
▸ ALDH1A1 P00352 4/20 0.43
▸ MAPT P10636 4/20 0.43
▸ LMNA P02545 2/20 0.41
▸ MITF O75030 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ G6PD P11413 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ MC4R P32245 1/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ CCR6 P51684 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ RAF1 P04049 3/20 0.41
▸ BRAF P15056 3/20 0.41
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL22729573 1.00 UGCG (0.51) UGCGPDE10AAXLALDH1A1MAPT
SCHEMBL29839394 0.93 UGCG (0.49) UGCGPDE10AAXLALDH1A1MAPT
SCHEMBL22729611 0.93 UGCG (0.49) UGCGPDE10AAXLALDH1A1MAPT
SCHEMBL22729625 0.90 PDE10A (0.49) PDE10AAXLALDH1A1MAPTLMNA
SCHEMBL29839336 0.90 PDE10A (0.49) PDE10AAXLALDH1A1MAPTLMNA
SCHEMBL22729798 0.82 KMT2A (0.53) PDE10AALDH1A1MAPTLMNAPKM
SCHEMBL29839342 0.82 KMT2A (0.53) PDE10AALDH1A1MAPTLMNAPKM
SCHEMBL22729551 0.79 MAPT (0.51) PDE10AALDH1A1MAPTLMNAMITF
SCHEMBL22755057 0.78 MAPT (0.53) ALDH1A1MAPTLMNAMITFPOLB
SCHEMBL22729397 0.78 UGCG (0.67) UGCGALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11459325-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-10-04 — — US 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-11459325-B2 Heterocyclic compound GBA1, GBA2, GALC UGCG 8/4885PDE10A 636/4885AXL 4608/4885

“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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