SCHEMBL4440043

SCHEMBL4440043

CCN1CCN(c2ccc(C(=O)O)nn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.46
▸ CHRNA7 P36544 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ PARP1 P09874 2/20 0.41
▸ PARP2 Q9UGN5 1/20 0.41
▸ DCTPP1 Q9H773 3/20 0.40
▸ SCD O00767 2/20 0.40
▸ HSD11B1 P28845 1/20 0.40
▸ PRKAA2 P54646 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAD52 P43351 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL4433479 0.84 AOC3 (0.48) HRH3KDM4EGAAPARP1PARP2
SCHEMBL64557 0.83 NPC1 (0.47) HRH3KDM4EPARP1DCTPP1SCD
SCHEMBL937146 0.81 DRD4 (0.50) PRKAA2ALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL25719351 0.81 PARP1 (0.44) PARP1PARP2SCDPRKAA2
SCHEMBL24620129 0.80 BPTF (0.54) KDM4EGAASCDALDH1A1HPGD
SCHEMBL27634139 0.79 HTR1A (0.52) DCTPP1SCDMEN1KMT2A
SCHEMBL938002 0.79 LMNA (0.48) GAADCTPP1SCD
SCHEMBL20021209 0.79 CYP1A2 (0.53) PARP1ALDH1A1HPGDRAB9ANPC1
SCHEMBL937485 0.78 SCD (0.48) DCTPP1SCD
SCHEMBL27654401 0.78 MAPT (0.46) KDM4ESCDALDH1A1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125748-A2 ACYLAMINOPYRAZOLES AS FGFR INHIBITORS AstraZeneca AB (SE) 2009-12-02 — — EP disclosed
WO-2008075068-A2 ACYLAMINOPYRAZOLES AS FGFR INHIBITORS ASTRAZENECA AB (SE) 2008-06-26 — — WO disclosed
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