SCHEMBL19580550

SCHEMBL19580550

FC(F)(F)Oc1ccc([C@H]2COCCN2)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NISCH Q9Y2I1 1/20 0.40
▸ GRIN2B Q13224 3/20 0.40
▸ WNT3A P56704 1/20 0.38
▸ TNKS2 Q9H2K2 1/20 0.38
▸ PRKDC P78527 1/20 0.37
▸ KDM1A O60341 1/20 0.37
▸ RCOR1 Q9UKL0 1/20 0.37
▸ PRKACA P17612 1/20 0.36
▸ PRKACG P22612 1/20 0.36
▸ PRKACB P22694 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ NOTUM Q6P988 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HTR2C P28335 1/20 0.34
▸ EPHX1 P07099 1/20 0.34
▸ EPHX2 P34913 2/20 0.34
▸ SCN10A Q9Y5Y9 1/20 0.33

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
SCHEMBL19580707 1.00 NISCH (0.40) NISCHGRIN2BWNT3ATNKS2PRKDC
Hydrochloric Acid SCHEMBL27174165 0.98 NISCH (0.39) NISCHGRIN2BWNT3ATNKS2PRKDC
Hydrochloric Acid SCHEMBL29650845 0.98 NISCH (0.39) NISCHGRIN2BWNT3ATNKS2PRKDC
SCHEMBL24540737 0.80 PRKACA (0.34) PRKACAPRKACGPRKACB
SCHEMBL17525131 0.80 HTR2C (0.45) NISCHWNT3ATNKS2KDM1APRKACA
SCHEMBL17524747 0.80 HTR2C (0.45) NISCHWNT3ATNKS2KDM1APRKACA
SCHEMBL24309493 0.80 GID4 (0.41) KDM1APRKACAPRKACGPRKACBMEN1
SCHEMBL19580500 0.79 LRRK2 (0.35) NISCHGRIN2BWNT3ATNKS2PRKDC
SCHEMBL14837281 0.79 CTSK (0.36) KDM1APRKACAPRKACGPRKACB
SCHEMBL24540923 0.79 KMT2A (0.40) PRKACAPRKACGPRKACBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4263545-A1 PRMTS INHIBITORS Amgen Inc. (US) 2023-10-25 — — EP disclosed
WO-2022132914-A1 PRMTS INHIBITORS AMGEN INC. (US) 2022-06-23 — — WO disclosed
EP-3177611-B1 OPTIONALLY FUSED HETEROCYCLYL-SUBSTITUTED DERIVATIVES OF PYRIMIDINE USEFUL FOR THE TREATMENT OF INFLAMMATORY, METABOLIC, ONCOLOGIC AND AUTOIMMUNE DISEASES NUEVOLUTION AS (DK) 2021-10-06 — — EP disclosed
US-20210188828-A1 COMPOUNDS ACTIVE TOWARDS NUCLEAR RECEPTORS NUEVOLUTION A/S (DK) 2021-06-24 — — US disclosed
US-10689383-B2 Optionally fused heterocyclyl-substituted derivatives of pyrimidine useful for the treatment of inflammatory, metabolic, oncologic and autoimmune diseases NUEVOLUTION A/S (DK) 2020-06-23 — — US disclosed
US-10689383-B2 Optionally fused heterocyclyl-substituted derivatives of pyrimidine useful for the treatment of inflammatory, metabolic, oncologic and autoimmune diseases NUEVOLUTION A/S (DK) 2020-06-23 — — US disclosed
US-20170327503-A1 OPTIONALLY FUSED HETEROCYCLYL-SUBSTITUTED DERIVATIVES OF PYRIMIDINE USEFUL FOR THE TREATMENT OF INFLAMMATORY, METABOLIC, ONCOLOGIC AND AUTOIMMUNE DISEASES NUEVOLUTION A/S (DK) 2017-11-16 — — US disclosed
US-20170327503-A1 OPTIONALLY FUSED HETEROCYCLYL-SUBSTITUTED DERIVATIVES OF PYRIMIDINE USEFUL FOR THE TREATMENT OF INFLAMMATORY, METABOLIC, ONCOLOGIC AND AUTOIMMUNE DISEASES NUEVOLUTION A/S (DK) 2017-11-16 — — US disclosed
US-20170327503-A1 OPTIONALLY FUSED HETEROCYCLYL-SUBSTITUTED DERIVATIVES OF PYRIMIDINE USEFUL FOR THE TREATMENT OF INFLAMMATORY, METABOLIC, ONCOLOGIC AND AUTOIMMUNE DISEASES NUEVOLUTION A/S (DK) 2017-11-16 — — 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 (3 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-10689383-B2 Optionally fused heterocyclyl-substituted derivatives of pyrimidine useful for the treatment of inflammatory, metabolic, oncologic and autoimmune diseases RORA, RORC, RORB NISCH 1872/4885GRIN2B 2043/4885WNT3A 2645/4885
US-20210188828-A1 COMPOUNDS ACTIVE TOWARDS NUCLEAR RECEPTORS NCOA1, NR1H2, NCOA3 NISCH 4683/4885GRIN2B 437/4885WNT3A 2147/4885
US-20170327503-A1 OPTIONALLY FUSED HETEROCYCLYL-SUBSTITUTED DERIVATIVES OF PYRIMIDINE USEFUL FOR THE TREATMENT OF INFLAMMATORY, METABOLIC, ONCOLOGIC AND AUTOIMMUNE DISEASES PPARD, PPARG, RORC NISCH 1263/4885GRIN2B 2066/4885WNT3A 4184/4885

“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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