SCHEMBL7295274

SCHEMBL7295274

Cc1ccc(CCNC(=O)CCCCC(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.60
POLB P06746 1/20 0.59
KMT2A Q03164 1/20 0.59
HPGD P15428 1/20 0.58
HDAC3 O15379 3/20 0.57
HDAC1 Q13547 3/20 0.57
HDAC2 Q92769 3/20 0.57
HDAC10 Q969S8 3/20 0.57
HDAC11 Q96DB2 3/20 0.57
HDAC8 Q9BY41 3/20 0.57
HDAC6 Q9UBN7 3/20 0.57
NCOR2 Q9Y618 2/20 0.57
LMNA P02545 1/20 0.57
TSHR P16473 1/20 0.57
PLAAT3 P53816 2/20 0.56
PLAAT5 Q96KN8 2/20 0.56
PLAAT2 Q9NWW9 2/20 0.56
PLAAT4 Q9UL19 2/20 0.56
HDAC4 P56524 2/20 0.55
HDAC9 Q9UKV0 2/20 0.55

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
SCHEMBL26739831 0.90 LMNA (0.65) RAB9AHDAC3HDAC1HDAC2HDAC10
SCHEMBL17117413 0.88 PLAAT3 (0.68) RAB9AHPGDHDAC3HDAC1HDAC2
SCHEMBL7280705 0.85 HDAC3 (0.77) HDAC3HDAC1HDAC2HDAC10HDAC11
SCHEMBL24179797 0.84 HDAC3 (0.63) RAB9APOLBKMT2AHPGDHDAC3
SCHEMBL26998004 0.84 POLB (0.59) RAB9APOLBKMT2AHPGDHDAC3
SCHEMBL25868917 0.84 POLB (0.59) RAB9APOLBKMT2AHPGDHDAC3
SCHEMBL25834953 0.84 POLB (0.59) RAB9APOLBKMT2AHPGDHDAC3
SCHEMBL7436977 0.84 HDAC3 (0.79) KMT2AHDAC3HDAC1HDAC2HDAC10
SCHEMBL7441298 0.84 HDAC3 (0.79) KMT2AHDAC3HDAC1HDAC2HDAC10
SCHEMBL7441870 0.84 HDAC3 (0.79) KMT2AHDAC3HDAC1HDAC2HDAC10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0223598-B1 CATECHOLAMINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF FISONS plc (GB) 1991-06-12 EP disclosed
US-4939147-A Substituted 3,4-dihydroxy phenylethylamino compounds FISONS PLC. (GB) 1990-07-03 US disclosed
US-4922022-A Substituted 3,4-dihydroxy phenylethylamino compounds FISONS PLC (GB) 1990-05-01 US disclosed
US-4883804-A Aromatic compounds FISONS PLC (GB) 1989-11-28 US disclosed
EP-0223598-A2 Catecholamine derivatives, processes for their preparation and pharmaceutical compositions thereof FISONS plc (GB) 1987-05-27 EP disclosed