SCHEMBL2378629

SCHEMBL2378629

FC(F)(F)Cn1cc(I)cn1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.38
LRRK2 Q5S007 3/20 0.35
FFAR1 O14842 1/20 0.33
ROCK1 Q13464 1/20 0.32
ACHE P22303 1/20 0.30
NAMPT P43490 1/20 0.30
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 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
SCHEMBL12017377 0.84 AR (0.41) ARFFAR1ACHE
SCHEMBL26389026 0.84 AR (0.41) ARFFAR1ACHE
SCHEMBL19313559 0.80 FADS1 (0.38) ARROCK1
SCHEMBL30200569 0.79 AR (0.40) ARFFAR1
SCHEMBL5515968 0.77 AR (0.38) AR
SCHEMBL1819606 0.76 FFAR1 (0.55) ARLRRK2FFAR1ROCK1NAMPT
SCHEMBL15518451 0.76 FFAR1 (0.37) ARFFAR1
SCHEMBL14991007 0.76 JAK2 (0.37) AR
SCHEMBL15885757 0.76 GSK3B (0.33) AR
SCHEMBL26388990 0.76

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11958831-B2 Pyrazole compounds, pharmaceutical compositions thereof and use thereof ARTIVILA (SHENZHEN) INNOVATION CENTER, LTD. (CN) 2024-04-16 US disclosed
EP-3845528-B1 PYRAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF AND USE THEREOF AS IRAK4 INHIBITORS ARTIVILA SHENZHEN INNOVATION CENTER LTD (CN) 2023-10-11 EP disclosed
EP-3845528-B1 PYRAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF AND USE THEREOF AS IRAK4 INHIBITORS ARTIVILA SHENZHEN INNOVATION CENTER LTD (CN) 2023-10-11 EP disclosed
WO-2023192901-A1 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-10-05 WO disclosed
WO-2023179600-A1 NOVEL SUBSTITUTED MACROHETEROCYCLIC COMPOUNDS AND USE THEREOF 杭州德睿智药科技有限公司 2023-09-28 WO disclosed
US-11667649-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents NUVALENT, INC. (US) 2023-06-06 US disclosed
US-11667649-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents NUVALENT, INC. (US) 2023-06-06 US disclosed
US-20230151016-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-05-18 US disclosed
US-20230151016-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-05-18 US disclosed
US-20230076627-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS NUVALENT, INC. 2023-03-09 US disclosed
US-7705030-B2 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for β-secretase modulation WYETH LLC (US) 2010-04-27 US disclosed
US-20080306091-A1 AMINO-5-(5-MEMBERED)HETERO-ARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR beta-SECRETASE MODULATION WYETH (US) 2008-12-11 US disclosed
US-20080306091-A1 AMINO-5-(5-MEMBERED)HETERO-ARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR beta-SECRETASE MODULATION WYETH (US) 2008-12-11 US disclosed
US-20080306091-A1 AMINO-5-(5-MEMBERED)HETERO-ARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR beta-SECRETASE MODULATION WYETH (US) 2008-12-11 US disclosed
US-7417047-B2 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for β-secretase modulation WYETH (US) 2008-08-26 US disclosed
US-7417047-B2 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for β-secretase modulation WYETH (US) 2008-08-26 US disclosed
US-7417047-B2 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for β-secretase modulation WYETH (US) 2008-08-26 US disclosed
US-20070004786-A1 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for beta-secretase modulation WYETH (US) 2007-01-04 US disclosed
US-20070004786-A1 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for beta-secretase modulation WYETH (US) 2007-01-04 US disclosed
US-20070004786-A1 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for beta-secretase modulation WYETH (US) 2007-01-04 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 (6 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-11667649-B2 Heteroaromatic macrocyclic ether chemotherapeutic agents CYP2C8, ABCB1, PAICS AR 135/4885LRRK2 4217/4885FFAR1 4290/4885
US-20230076627-A1 HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS CYP2C8, ABCB1, PAICS AR 135/4885LRRK2 4217/4885FFAR1 4290/4885
US-11958831-B2 Pyrazole compounds, pharmaceutical compositions thereof and use thereof IRAK3, IRAK1, IRAK2 AR 3191/4885LRRK2 509/4885FFAR1 2325/4885
US-20070004786-A1 Amino-5-(5-membered)hetero-arylimidazolone compounds and the use thereof for beta-secretase modulation BACE1, BACE2, APP AR 3419/4885LRRK2 54/4885FFAR1 3887/4885
US-20080306091-A1 AMINO-5-(5-MEMBERED)HETERO-ARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR beta-SECRETASE MODULATION BACE1, BACE2, APP AR 3419/4885LRRK2 54/4885FFAR1 3887/4885
US-20230151016-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS PDK1, PDK2, PKM AR 3857/4885LRRK2 684/4885FFAR1 2863/4885

“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.