SCHEMBL9510385

SCHEMBL9510385

CCCCc1ccc(Nc2ccc(NC(=O)c3ccccc3)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.64
▸ TSHR P16473 1/20 0.64
▸ TRPV1 Q8NER1 2/20 0.56
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ MMP14 P50281 1/20 0.54
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ MAPK1 P28482 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ PLK1 P53350 9/20 0.49
▸ PLK3 Q9H4B4 5/20 0.49
▸ KDM4E B2RXH2 3/20 0.48
▸ GALR3 O60755 1/20 0.45
▸ APAF1 O14727 1/20 0.45
▸ MITF O75030 1/20 0.45

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
SCHEMBL10732288 0.87 NPC1 (0.62) CYP1A2TSHRTRPV1MEN1KMT2A
SCHEMBL10796638 0.83 CYP1A2 (0.78) CYP1A2TSHRMEN1KMT2AMMP14
SCHEMBL9203934 0.83 MAPT (0.76) CYP1A2TSHRTRPV1MEN1KMT2A
SCHEMBL11533589 0.83 CYP1A2 (0.73) CYP1A2TSHRMEN1KMT2AMMP14
SCHEMBL11060750 0.83 RAB9A (0.57) CYP1A2TSHRTRPV1MEN1KMT2A
SCHEMBL14489853 0.82 NPC1 (0.60) CYP1A2MEN1KMT2ANPC1RAB9A
SCHEMBL14049079 0.81 TRPV1 (0.52) CYP1A2TSHRTRPV1MEN1KMT2A
SCHEMBL11536466 0.80 CYP1A2 (0.73) CYP1A2TSHRMEN1KMT2AMMP14
SCHEMBL14101256 0.80 CYP1A2 (0.77) CYP1A2TSHRMEN1KMT2AMMP14
SCHEMBL13135365 0.80 NPC1 (0.65) CYP1A2TSHRMEN1KMT2ANPC1

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
EP-0409636-B1 THERMAL TRANSFER IMAGING USING ALKYLCARBONYLAMINO-ANTHRAQUINONE DYES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-09-01 — — EP disclosed
US-4988664-A THERMAL TRANSFER IMAGE, LAYER WITH ANTHRAQUINONE DYE, MULTILAYER ELEMENT FOR TEXTILES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-01-29 — — US disclosed
EP-0409636-A1 Thermal transfer imaging using alkylcarbonylamino-anthraquinone dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-01-23 — — EP disclosed
EP-0020292-A1 Auxiliary supports for transfer printing and thermographic printing process using these supports SUBLISTATIC HOLDING S.A. (CH) 1980-12-10 — — EP disclosed
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