SCHEMBL630856

SCHEMBL630856

Cc1ccc(N2CCN(C(=O)O)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.65
LMNA P02545 4/20 0.59
MAPT P10636 7/20 0.54
ALDH1A1 P00352 4/20 0.54
HPGD P15428 2/20 0.54
HTT P42858 2/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
GLA P06280 1/20 0.53
POLB P06746 3/20 0.52
GFER P55789 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 2/20 0.52
GAA P10253 2/20 0.52
ALOX15 P16050 2/20 0.52
ALOX12 P18054 1/20 0.52
CASP6 P55212 1/20 0.51
TSHR P16473 1/20 0.51
ADRB1 P08588 1/20 0.50
NPC1 O15118 1/20 0.50

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
SCHEMBL82046 0.85 GFER (0.71) AKR1C3LMNAMAPTALDH1A1HPGD
SCHEMBL9410734 0.83 AKR1C3 (0.63) AKR1C3LMNAMAPTALDH1A1HPGD
SCHEMBL13257760 0.83 AKR1C3 (0.63) AKR1C3LMNAMAPTALDH1A1HPGD
SCHEMBL3466014 0.82 TDP1 (0.64) LMNAMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL631962 0.82 ALDH1A1 (0.69) AKR1C3LMNAMAPTALDH1A1HTT
SCHEMBL3028108 0.81 MAPT (0.69) LMNAMAPTALDH1A1HTTPOLB
SCHEMBL22542072 0.81 AKR1C3 (0.76) AKR1C3LMNAMAPTALDH1A1HPGD
SCHEMBL7105773 0.81 ADRB1 (0.70) AKR1C3LMNAMAPTALDH1A1HPGD
SCHEMBL10063748 0.81 ADRB1 (0.70) AKR1C3LMNAMAPTALDH1A1HPGD
SCHEMBL3414344 0.81 ADRB1 (0.70) AKR1C3LMNAMAPTALDH1A1HPGD

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
EP-2234992-B1 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2012-02-22 EP claimed
EP-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 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-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 AKR1C3 959/4885LMNA 4411/4885MAPT 2430/4885
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF ABL1, MAP3K20, MAP3K1 AKR1C3 2786/4885LMNA 2388/4885MAPT 1229/4885

“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.