SCHEMBL19605877

SCHEMBL19605877

Cc1ccc(CN2CCN(CC(=O)O)CCN(CC(=O)O)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.66
▸ POLB P06746 2/20 0.66
▸ ALDH1A1 P00352 4/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ ATM Q13315 2/20 0.57
▸ KDM4E B2RXH2 3/20 0.57
▸ MEN1 O00255 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ FAAH O00519 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ S1PR1 P21453 1/20 0.53
▸ S1PR5 Q9H228 1/20 0.53
▸ HRH3 Q9Y5N1 1/20 0.52

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
SCHEMBL19403152 1.00 LMNA (0.66) LMNAPOLBALDH1A1SMN1; SMN2ATM
SCHEMBL15363580 1.00 LMNA (0.66) LMNAPOLBALDH1A1SMN1; SMN2ATM
SCHEMBL26316648 0.94 HRH3 (0.61) LMNAPOLBALDH1A1SMN1; SMN2ATM
SCHEMBL23977354 0.92 LMNA (0.60) LMNAPOLBALDH1A1SMN1; SMN2ATM
SCHEMBL24115228 0.91 LMNA (0.55) LMNAPOLBALDH1A1SMN1; SMN2ATM
SCHEMBL26908807 0.90 LMNA (0.54) LMNAPOLBALDH1A1SMN1; SMN2ATM
SCHEMBL22361385 0.86 KDM4E (0.63) POLBALDH1A1SMN1; SMN2ATMKDM4E
SCHEMBL18292063 0.86 KDM4E (0.63) POLBALDH1A1SMN1; SMN2ATMKDM4E
SCHEMBL18292042 0.86 KDM4E (0.63) POLBALDH1A1SMN1; SMN2ATMKDM4E
SCHEMBL15867646 0.85 ALDH1A1 (0.59) LMNAPOLBALDH1A1SMN1; SMN2ATM

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
WO-2024052333-A1 MULTIVALENT FIBROBLAST ACTIVATION PROTEIN LIGANDS FOR TARGETED DELIVERY APPLICATIONS PHILOCHEM AG (CH) 2024-03-14 — — WO disclosed
WO-2023144379-A1 HIGH-AFFINITY LIGANDS OF FIBROBLAST ACTIVATION PROTEIN FOR TARGETED DELIVERY APPLICATIONS PHILOCHEM AG (CH) 2023-08-03 — — WO disclosed
EP-3455222-B1 NUCLEAR IMAGING AND RADIOTHERAPEUTICS AGENTS TARGETING CARBONIC ANHYDRASE IX AND USES THEREOF UNIV JOHNS HOPKINS (US) 2022-03-02 — — EP disclosed
WO-2017197251-A1 NUCLEAR IMAGING AND RADIOTHERAPEUTICS AGENTS TARGETING CARBONIC ANHYDRASE IX AND USES THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2017-11-16 — — WO disclosed
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