SCHEMBL11647308

SCHEMBL11647308

Cc1ccc(Oc2ccc(NC(=O)CN)cc2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.56
▸ POLB P06746 1/20 0.53
▸ PFKFB2 O60825 5/20 0.52
▸ PFKFB3 Q16875 5/20 0.52
▸ PFKFB1 P16118 4/20 0.52
▸ NSD2 O96028 2/20 0.52
▸ AS3MT Q9HBK9 2/20 0.52
▸ MAPT P10636 4/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ MTNR1A P48039 2/20 0.50
▸ MTNR1B P49286 2/20 0.50
▸ DOT1L Q8TEK3 1/20 0.50
▸ LTA4H P09960 1/20 0.50
▸ GAA P10253 2/20 0.49
▸ MMP2 P08253 1/20 0.49
▸ MMP9 P14780 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49

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
SCHEMBL11645520 0.87 ALDH1A1 (0.56) HPGDPOLBMAPTALDH1A1KMT2A
SCHEMBL11646606 0.84 LTA4H (0.62) HPGDPOLBMAPTALDH1A1KMT2A
SCHEMBL11645836 0.84 ALDH1A1 (0.52) HPGDPFKFB2PFKFB3PFKFB1NSD2
SCHEMBL11641172 0.83 LTA4H (0.67) POLBALDH1A1KMT2AMEN1TDP1
SCHEMBL11642665 0.81 L3MBTL1 (0.63) HPGDMAPTALDH1A1KMT2AMEN1
SCHEMBL11645672 0.81 MEN1 (0.60) POLBMAPTALDH1A1KMT2AMEN1
SCHEMBL13832459 0.81 MTNR1B (0.52) HPGDMAPTALDH1A1KMT2AMEN1
SCHEMBL11648480 0.80 SMN1; SMN2 (0.66) HPGDPOLBPFKFB2PFKFB3PFKFB1
SCHEMBL11644190 0.80 MTNR1B (0.78) HPGDMTNR1AMTNR1B
SCHEMBL11645364 0.80 RNF4 (0.71) HPGDPOLBMAPTALDH1A1KMT2A

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
US-4088780-A ANTHELMINTIC AGENTS BAYER AKTIENGESELLSCHAFT (DT) 1978-05-09 — — US disclosed
US-4032655-A PHENYLGUANIDINES USEFUL AS ANTHELMINTIC AGENTS BAYER AKTIENGESELLSCHAFT (DT) 1977-06-28 — — US disclosed
US-4024176-A Substituted phenylguanidines and processes for their preparation and use BAYER AKTIENGESELLSCHAFT (DT) 1977-05-17 — — US disclosed
US-3993682-A Substituted phenylguanidines and processes for their preparation and use BAYER AKTIENGESELLSCHAFT (DT) 1976-11-23 — — US disclosed
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