SCHEMBL9673278

SCHEMBL9673278

O=C(Cl)c1ccc(C(=O)Cl)c(Oc2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.42
POLB P06746 1/20 0.42
MCL1 Q07820 3/20 0.41
GALK1 P51570 1/20 0.41
CASP6 P55212 1/20 0.41
PLEC Q15149 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
BCL2L1 Q07817 1/20 0.41
MAP3K8 P41279 1/20 0.40
CYP1A2 P05177 1/20 0.40
GAA P10253 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
CYP2C19 P33261 1/20 0.40
MBTD1 Q05BQ5 1/20 0.39
L3MBTL3 Q96JM7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PARP10 Q53GL7 1/20 0.39
CASP1 P29466 2/20 0.39
MAPT P10636 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
SCHEMBL9672152 0.91 PARP10 (0.49) TTRPOLBMBTD1L3MBTL3L3MBTL1
SCHEMBL8752172 0.91 TTR (0.50) TTRPOLBBCL2L1MBTD1L3MBTL3
SCHEMBL11332512 0.83 PARP10 (0.46) TTRPOLBTDP1L3MBTL1PARP10
SCHEMBL9325745 0.83 CTNNB1 (0.54) TDP1MAP3K8CYP1A2GAACYP2C9
SCHEMBL9671798 0.82 PPARA (0.45) TTRMCL1BCL2L1
SCHEMBL9672200 0.82 KMT2A (0.40) TTRPOLBMCL1L3MBTL1MAPT
SCHEMBL9536693 0.81 PARP10 (0.53) MCL1BCL2L1PARP10MAPTSMN1; SMN2
SCHEMBL9243809 0.80 POLB (0.47) TTRPOLBPARP10SMN1; SMN2
SCHEMBL9186446 0.77 PARP10 (0.58) MCL1BCL2L1PARP10SMN1; SMN2
SCHEMBL9243798 0.74 PARP10 (0.53) TTRL3MBTL1PARP10

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
US-5134219-A STIFF-CHAIN POLYHETEROCYCLES HAVING IMPROVED SOLUBILITY, A PROCESS FOR THEIR PRODUCTION AND THEIR USE BAYER AKTIENGESELLSCHAFT (DE) 1992-07-28 US disclosed
EP-0432562-A1 Polyhétérocycles with rigid chain and better solubility, their process of production and use BAYER AG (DE) 1991-06-19 EP disclosed