SCHEMBL18323973

SCHEMBL18323973

CCc1c(OCc2ccc(C(=O)N3CCN(C)CC3)cc2)cccc1C(C)=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 6/20 0.55
▸ USP2 O75604 2/20 0.55
▸ AVPR2 P30518 2/20 0.50
▸ AVPR1A P37288 2/20 0.50
▸ ALDH1A1 P00352 6/20 0.48
▸ ABL1 P00519 1/20 0.48
▸ RIN1 Q13671 1/20 0.48
▸ MAPT P10636 3/20 0.48
▸ ATM Q13315 1/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ HRH3 Q9Y5N1 2/20 0.45
▸ POLB P06746 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43

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
SCHEMBL12445084 0.79 CRBN (0.46) HPGDUSP2AVPR2AVPR1AALDH1A1
SCHEMBL7760917 0.74 GAA (0.58) HPGDUSP2ALDH1A1ABL1RIN1
SCHEMBL11955563 0.73 HRH3 (0.66) HPGDNPC1SMN1; SMN2RAB9AHRH3
SCHEMBL19608587 0.72 HRH3 (0.61) HPGDUSP2MAPTNPC1SMN1; SMN2
SCHEMBL16193403 0.72 MAPK14 (0.38) HPGDALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL10322800 0.71 HPGD (0.59) HPGDUSP2AVPR2AVPR1AALDH1A1
SCHEMBL19222209 0.71 ESR2 (0.42) HRH3POLBMEN1KMT2A
SCHEMBL2377726 0.69 HRH3 (0.64) HPGDUSP2NPC1SMN1; SMN2HRH3
SCHEMBL9356201 0.69 HPGD (0.62) HPGDUSP2ALDH1A1ABL1RIN1
SCHEMBL1649233 0.69 HPGD (0.56) HPGDUSP2AVPR2AVPR1AALDH1A1

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-4289838-A2 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME Celgene Corporation (US) 2023-12-13 — — EP disclosed
EP-3599236-A1 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME Celgene Corporation (US) 2020-01-29 — — EP disclosed
EP-3202461-A1 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME Celgene Corporation (US) 2017-08-09 — — EP disclosed
EP-3202460-A1 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME Celgene Corporation (US) 2017-08-09 — — EP disclosed
EP-3106460-A1 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME Celgene Corporation (US) 2016-12-21 — — EP disclosed
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