SCHEMBL3515528

SCHEMBL3515528

O=C(c1cccc(C(F)(F)F)c1)C1CCCCN1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
POLB P06746 1/20 0.53
HPGD P15428 1/20 0.53
CNR2 P34972 1/20 0.47
CES2 O00748 1/20 0.47
KMT2A Q03164 1/20 0.46
HSD11B1 P28845 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
MGLL Q99685 1/20 0.46
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RBP4 P02753 1/20 0.44
SRD5A2 P31213 1/20 0.44

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
SCHEMBL3515523 1.00 LMNA (0.53) LMNAPOLBHPGDCNR2CES2
SCHEMBL5339926 0.83 TDP1 (0.48) HSD11B1SMN1; SMN2
SCHEMBL4776003 0.82 MGLL (0.48) MGLLALDH1A1
SCHEMBL3088285 0.81 MCL1 (0.46) HPGDALDH1A1SMN1; SMN2
SCHEMBL5172182 0.81 MCL1 (0.46) HPGDALDH1A1SMN1; SMN2
SCHEMBL3515035 0.81 MGLL (0.43) KMT2AMGLL
SCHEMBL3518713 0.81 HPGD (0.51) HPGDKMT2AALDH1A1
SCHEMBL3518717 0.81 HPGD (0.51) HPGDKMT2AALDH1A1
SCHEMBL3515032 0.81 MGLL (0.43) KMT2AMGLL
SCHEMBL10132515 0.80 UCHL1 (0.51) LMNAPOLBHPGDKMT2ATAS1R3

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-20100298377-A1 NOVEL SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2010-11-25 US disclosed
EP-2170865-A2 NOVEL SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF, AND USE OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2010-04-07 EP disclosed
WO-2009010660-A2 SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF, AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2009-01-22 WO 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-20100298377-A1 NOVEL SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF AND USE OF SAME IN THERAPEUTICS WEE1, PRMT1, ABL1 LMNA 3126/4885POLB 3107/4885HPGD 2367/4885

“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.