SCHEMBL22019113

SCHEMBL22019113

CCc1cc(C(C)C)c(F)cc1C(C)C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EIF4A3 P38919 1/20 0.38
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
FABP3 P05413 1/20 0.31
FABP4 P15090 1/20 0.31
FABP5 Q01469 1/20 0.31
DPP4 P27487 1/20 0.31
PDE2A O00408 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 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
SCHEMBL22185877 0.89 DPP4 (0.39) EIF4A3ALOX15ALOX12FABP3FABP4
SCHEMBL14404558 0.87 DPP4 (0.38) EIF4A3ALOX15ALOX12FABP3FABP4
SCHEMBL12896237 0.87 DPP4 (0.38) EIF4A3ALOX15ALOX12FABP3FABP4
SCHEMBL27308803 0.83 EIF4A3 (0.36) EIF4A3ALOX15ALOX12
SCHEMBL10552802 0.82 EIF4A3 (0.35) EIF4A3PDE2A
SCHEMBL22251582 0.82 ALOX15 (0.46) ALOX15ALOX12
SCHEMBL13413598 0.82 GRIN2D (0.39) EIF4A3ALOX15ALOX12PDE2A
SCHEMBL9418090 0.82 TRPV4 (0.31)
SCHEMBL6269855 0.81 ALOX15 (0.37) ALOX15ALOX12FABP3FABP4FABP5
SCHEMBL24868584 0.81 GABRA1 (0.33) EIF4A3DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023083269-A1 AROMATIC HETEROCYCLIC COMPOUND AND APPLICATION THEREOF 中国科学院上海药物研究所 2023-05-19 WO disclosed
WO-2023279986-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF 贝达药业股份有限公司 2023-01-12 WO disclosed
US-20220175754-A1 P97 INHIBITORS FOR TREATING CANCER AND NEURODEGENERATIVE DISORDERS LUNDQUIST INST FOR BIOMEDICAL INNOVATION AT HARBOR UCLA MEDICAL CENTER (US) 2022-06-09 US disclosed
US-20200155536-A1 P97 INHIBITORS FOR TREATING CANCER AND NEURODEGENERATIVE DISORDERS LOS ANGELES BIOMEDICAL RESEARCH INSTITUTE AT HARBOR-UCLA MEDICAL CENTER 2020-05-21 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 (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-20200155536-A1 P97 INHIBITORS FOR TREATING CANCER AND NEURODEGENERATIVE DISORDERS PML, TARDBP, PRNP EIF4A3 1324/4885ALOX15 4227/4885ALOX12 4084/4885
US-20220175754-A1 P97 INHIBITORS FOR TREATING CANCER AND NEURODEGENERATIVE DISORDERS PML, TARDBP, PRNP EIF4A3 1324/4885ALOX15 4227/4885ALOX12 4084/4885

“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.