SCHEMBL4124526

SCHEMBL4124526

CCC(=O)Nc1cccc(C2CC2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.59
NR4A1 P22736 1/20 0.59
RAB9A P51151 1/20 0.59
GAA P10253 1/20 0.58
BRAF P15056 1/20 0.58
KMT2A Q03164 4/20 0.55
MEN1 O00255 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
LMNA P02545 1/20 0.54
SMYD3 Q9H7B4 1/20 0.52
PRKCI P41743 1/20 0.51
DRD4 P21917 4/20 0.51
DRD2 P14416 2/20 0.51
DRD3 P35462 2/20 0.51
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
AKT1 P31749 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL3556953 0.90 POLB (0.52) POLBNR4A1RAB9AGAABRAF
SCHEMBL22417190 0.88 DRD2 (0.59) POLBNR4A1RAB9AGAADRD4
SCHEMBL16835012 0.87 DRD4 (0.55) POLBNR4A1RAB9AGAABRAF
SCHEMBL28136923 0.84 SMN1; SMN2 (0.57) KMT2AMEN1L3MBTL1PRKCIDRD4
SCHEMBL4767684 0.82 DRD2 (0.55) DRD4DRD2DRD3
SCHEMBL28089268 0.82 DRD4 (0.47) POLBNR4A1RAB9AGAABRAF
SCHEMBL10970617 0.81 RAB9A (0.85) POLBNR4A1RAB9AGAAKMT2A
SCHEMBL5659857 0.81 NAMPT (0.54) RAB9ALMNADRD4DRD2DRD3
SCHEMBL17912996 0.80 PRKCI (0.56) BRAFPRKCIDRD4DRD2DRD3
SCHEMBL11752158 0.79 POLB (0.66) POLBNR4A1RAB9AGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227480-B2 Indazole derivative having spiro ring structure in side chain UBE INDUSTRIES, LTD. (JP) 2012-07-24 US disclosed
US-20090170887-A1 Novel indazole derivative having spiro ring structure in side chain SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-07-02 US disclosed
EP-2025676-A1 NOVEL INDAZOLE DERIVATIVE HAVING SPIRO RING STRUCTURE IN SIDE CHAIN Ube Industries, Ltd. (JP) 2009-02-18 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 (1 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-20090170887-A1 Novel indazole derivative having spiro ring structure in side chain CIT, ROCK1, ROCK2 POLB 3306/4885NR4A1 1258/4885RAB9A 668/4885

“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.