SCHEMBL9257525

SCHEMBL9257525

O=C(Cl)Oc1ccc2ccccc2c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.49
PTPN22 Q9Y2R2 1/20 0.47
NCEH1 Q6PIU2 7/20 0.46
LMNA P02545 5/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 2/20 0.43
TP53 P04637 2/20 0.43
RAB9A P51151 2/20 0.43
POLB P06746 2/20 0.43
HPGD P15428 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL7761409 0.84 LDHA (0.55) LDHAPTPN22NCEH1LMNA
SCHEMBL8125235 0.82 LDHA (0.49) LDHAPTPN22NCEH1LMNAPOLB
SCHEMBL6142391 0.82 NCEH1 (0.51) LDHAPTPN22NCEH1LMNASMN1; SMN2
SCHEMBL7197218 0.82 NCEH1 (0.46) NCEH1LMNASMN1; SMN2NPC1TP53
SCHEMBL11863351 0.81 NCEH1 (0.65) NCEH1LMNASMN1; SMN2NPC1TP53
SCHEMBL878536 0.79 ALDH1A1 (0.61) RAB9APOLBHPGDTDP1L3MBTL1
SCHEMBL10722642 0.79 KMT2A (0.55) LDHAPTPN22LMNASMN1; SMN2POLB
SCHEMBL7081718 0.79 NCEH1 (0.49) LDHANCEH1LMNAHPGDKDM4E
SCHEMBL10773502 0.78 TSHR (0.50) NCEH1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL3917320 0.77 CYP1A2 (0.44) NCEH1LMNASMN1; SMN2NPC1TP53

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
EP-0449109-B1 Indonaphthol dyes and a process for their thermal transfer BASF AG (DE) 1995-07-12 EP disclosed
EP-0449109-A2 Indonaphthol dyes and a process for their thermal transfer BASF Aktiengesellschaft (DE) 1991-10-02 EP disclosed