SCHEMBL11615774

SCHEMBL11615774

Cc1ccc(C(=O)Oc2cc(C)nn2CCOc2ccc3ccccc3c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.53
▸ MAPT P10636 4/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ RAB9A P51151 1/20 0.44
▸ MEN1 O00255 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ HPGD P15428 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ TP53 P04637 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ ENPP3 O14638 1/20 0.40
▸ ALPL P05186 1/20 0.40
▸ XIAP P98170 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ NPSR1 Q6W5P4 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
SCHEMBL11613986 0.93 KMT2A (0.53) KMT2AMAPTALOX15RAB9AMEN1
SCHEMBL11615175 0.92 MAPT (0.52) KMT2AMAPTALOX15RAB9AMEN1
SCHEMBL11613653 0.92 MAPT (0.52) KMT2AMAPTALOX15RAB9AMEN1
SCHEMBL11610558 0.86 MAPT (0.50) KMT2AMAPTALOX15RAB9AMEN1
SCHEMBL11612294 0.86 RAB9A (0.48) KMT2AMAPTALOX15RAB9AMEN1
SCHEMBL11615378 0.85 KMT2A (0.49) KMT2AMAPTALOX15RAB9AMEN1
SCHEMBL11615128 0.84 KMT2A (0.47) KMT2AMAPTALOX15RAB9AMEN1
SCHEMBL11618012 0.81 KMT2A (0.42) KMT2AMAPTALOX15RAB9AMEN1
SCHEMBL11615627 0.79 TDP1 (0.50) KMT2AMAPTRAB9AMEN1TDP1
SCHEMBL11615355 0.77 RAB9A (0.43) KMT2AMAPTALOX15RAB9AMEN1

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
US-4117145-A DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1978-09-26 — — US disclosed
US-4117143-A USED AS ANTITHROMBOTIC AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1978-09-26 — — US disclosed
US-4113957-A DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DE) 1978-09-12 — — US disclosed
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