SCHEMBL4028374

SCHEMBL4028374

O=C(Cl)C1(C(F)(F)F)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.40
RIPK1 Q13546 1/20 0.33
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30
PSENEN Q9NZ42 1/20 0.30

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
SCHEMBL1939082 0.93 DGAT1 (0.41) DGAT1RIPK1
SCHEMBL690946 0.87 DGAT1 (0.50) DGAT1
SCHEMBL9446531 0.80 DGAT1 (0.43) DGAT1RIPK1PSEN1PSEN2APH1B
SCHEMBL25325201 0.79 DGAT1 (0.43) DGAT1
SCHEMBL9694952 0.78 DGAT1 (0.41) DGAT1RIPK1
SCHEMBL696271 0.78 DGAT1 (0.41) DGAT1RIPK1
SCHEMBL28167619 0.77 DGAT1 (0.44) DGAT1RIPK1PSEN1PSEN2APH1B
Hydrochloric Acid SCHEMBL12479454 0.76 DGAT1 (0.40) DGAT1RIPK1
SCHEMBL5730111 0.76 TSHR (0.30)
SCHEMBL2405619 0.76 DGAT1 (0.45) DGAT1RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4605409-A2 CYCLIN INHIBITORS Circle Pharma, Inc. (US) 2025-08-27 EP disclosed
US-20240218021-A1 CYCLIN INHIBITORS CIRCLE PHARMA, INC. 2024-07-04 US disclosed
WO-2024086814-A2 CYCLIN INHIBITORS CIRCLE PHARMA, INC. (US) 2024-04-25 WO disclosed
US-20230265085-A1 RET KINASE INHIBITORS LOXO ONCOLOGY, INC. 2023-08-24 US disclosed
US-11697647-B2 RET kinase inhibitors ELI LILLY AND COMPANY (US) 2023-07-11 US disclosed
WO-2022098970-A9 PYRAZOLE DERIVATIVES AS RET KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2023-04-27 WO disclosed
US-20220144816-A1 RET KINASE INHIBITORS EVOTEC INTERNATIONAL GMBH (DE) 2022-05-12 US disclosed
WO-2022098970-A1 PYRAZOLE DERIVATIVES ASR ET KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2022-05-12 WO disclosed
WO-2009100403-A1 SUBSTITUTED ARYL PYRIMIDINONES NEUROGEN CORPORATION (US) 2009-08-13 WO disclosed
WO-2008017688-A1 2-CARBOXY THIOPHENE DERIVATIVES AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-14 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 (4 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-20240218021-A1 CYCLIN INHIBITORS CCNI, CCNC, CDK2 DGAT1 3219/4885RIPK1 2867/4885PSEN1 1519/4885
US-11697647-B2 RET kinase inhibitors RET, BRAF, GFRA1 DGAT1 4180/4885RIPK1 378/4885PSEN1 3351/4885
US-20230265085-A1 RET KINASE INHIBITORS RET, BRAF, GFRA1 DGAT1 4180/4885RIPK1 378/4885PSEN1 3351/4885
US-20220144816-A1 RET KINASE INHIBITORS RET, BRAF, GFRA1 DGAT1 4180/4885RIPK1 378/4885PSEN1 3351/4885

“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.