SCHEMBL5984752

SCHEMBL5984752

[CH2]CCCCC(C)(C)C[CH2]

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.33
CPT2 P23786 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL5985567 0.91
SCHEMBL1973779 0.80 TSHR (0.37)
SCHEMBL625211 0.80 TDP1 (0.32) FFAR1CPT2TDP1
SCHEMBL25385320 0.78 FFAR1 (0.36) FFAR1CPT2TDP1
SCHEMBL10758322 0.78 TSHR (0.42) FFAR1CPT2TDP1
SCHEMBL8008366 0.78 FFAR1 (0.36) FFAR1CPT2TDP1
SCHEMBL25384743 0.78 TSHR (0.35)
SCHEMBL25386399 0.78 FFAR1 (0.36) FFAR1CPT2TDP1
SCHEMBL8755240 0.78 TSHR (0.42) FFAR1CPT2TDP1
SCHEMBL22749064 0.78 TSHR (0.42) FFAR1CPT2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7018993-B2 Antiandrogenic agent CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-03-28 US disclosed
US-20030158164-A1 Novel antiandrogenic agent CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-21 US disclosed
EP-1304334-A1 NOVEL ANTIANDROGENIC AGENT CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-04-23 EP disclosed
EP-1219631-A1 ANTIANDROGEN AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-07-03 EP disclosed
US-6410523-B1 BONE DEFECTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-06-25 US disclosed
US-20020045772-A1 Vitamin D derivative having substituent at 2beta-position CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-04-18 US disclosed
EP-1070704-A1 VITAMIN D DERIVATIVES SUBSTITUTED AT THE 2$g(b)-POSITION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-01-24 EP 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-20020045772-A1 Vitamin D derivative having substituent at 2beta-position CYP2R1, CYP24A1, VDR FFAR1 652/4885CPT2 1328/4885TDP1 4663/4885
US-20030158164-A1 Novel antiandrogenic agent NR5A1, CYP19A1, HSD17B11 FFAR1 240/4885CPT2 542/4885TDP1 3394/4885

“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.