SCHEMBL30158331

SCHEMBL30158331

Cc1cc(C(=O)Cn2ncc(Cl)c(Cl)c2=O)ccc1Cl

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.70
HTT P42858 13/20 0.70
MITF O75030 8/20 0.70
SMN1; SMN2 Q16637 8/20 0.70
MAPT P10636 7/20 0.70
S1PR4 O95977 4/20 0.70
S1PR1 P21453 4/20 0.70
TP53 P04637 1/20 0.70
NPSR1 Q6W5P4 9/20 0.67
POLB P06746 3/20 0.67
RAB9A P51151 10/20 0.65
LMNA P02545 8/20 0.65
NPC1 O15118 8/20 0.54
S1PR2 O95136 2/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
HCRTR1 O43613 1/20 0.53
HSP90AA1 P07900 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53

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
SCHEMBL31172053 0.85 ALDH1A1 (0.80) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL30158470 0.85 ALDH1A1 (0.70) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL31172052 0.82 ALDH1A1 (1.00) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL31172061 0.81 ALDH1A1 (0.70) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL24780120 0.80 ALDH1A1 (0.74) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL2894717 0.78 ALDH1A1 (0.72) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL24780121 0.77 ALDH1A1 (0.74) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL24779795 0.76 MAPT (0.77) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL31172062 0.75 ALDH1A1 (0.71) ALDH1A1HTTMITFSMN1; SMN2MAPT
SCHEMBL2888078 0.74 HTT (0.69) ALDH1A1HTTMITFSMN1; SMN2MAPT

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-4351518-A1 PYRIDAZINONES FOR THE TREATMENT OR PREVENTION OF HYPERTENSION Universitetet I Oslo (NO) 2024-04-17 EP disclosed
WO-2022258992-A1 PYRIDAZINONES FOR THE TREATMENT OR PREVENTION OF HYPERTENSION UNIVERSITETET I OSLO (NO) 2022-12-15 WO disclosed