SCHEMBL215925

SCHEMBL215925

Cc1cc(N2CCN(C(=O)O)CC2)ccc1[N+](=O)[O-]

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.68
ADAMTS5 Q9UNA0 1/20 0.54
SIRT6 Q8N6T7 4/20 0.53
MAPT P10636 9/20 0.51
ALDH1A1 P00352 7/20 0.51
CYP2C19 P33261 2/20 0.51
DCTPP1 Q9H773 1/20 0.51
MEN1 O00255 1/20 0.51
CYP2C9 P11712 1/20 0.51
KMT2A Q03164 1/20 0.51
TSHR P16473 1/20 0.50
RECQL P46063 1/20 0.49
KDM4E B2RXH2 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
BLM P54132 1/20 0.48
CYP1A2 P05177 1/20 0.48

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
SCHEMBL215924 1.00 HPGD (0.68) HPGDADAMTS5SIRT6MAPTALDH1A1
SCHEMBL10360254 0.89 HPGD (0.68) HPGDADAMTS5SIRT6MAPTALDH1A1
SCHEMBL16262194 0.87 SIRT6 (0.54) HPGDSIRT6MAPTALDH1A1CYP2C19
SCHEMBL16262196 0.87 SIRT6 (0.54) HPGDSIRT6MAPTALDH1A1CYP2C19
SCHEMBL25787624 0.85 HPGD (0.63) HPGDADAMTS5SIRT6MAPTALDH1A1
SCHEMBL14432027 0.84 HPGD (0.69) HPGDADAMTS5SIRT6MAPTALDH1A1
SCHEMBL7050664 0.84 HPGD (0.88) HPGDSIRT6MAPTALDH1A1CYP2C19
SCHEMBL17958719 0.83 SMN1; SMN2 (0.54) SIRT6MAPTALDH1A1CYP2C19DCTPP1
SCHEMBL213791 0.83 LMNA (0.69) HPGDSIRT6MAPTALDH1A1CYP2C19
SCHEMBL17958720 0.83 SMN1; SMN2 (0.54) SIRT6MAPTALDH1A1CYP2C19DCTPP1

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
WO-2024141052-A1 ESTROGEN-RECEPTOR MODULATOR AND USE THEREOF 江苏威凯尔医药科技有限公司 2024-07-04 WO disclosed
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 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 (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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 HPGD 3138/4885ADAMTS5 1878/4885SIRT6 3316/4885

“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.