SCHEMBL3227993

SCHEMBL3227993

CC(C)(C)c1ccc(Oc2ccc3c(c2)C(=N)NC3=N)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ ADAMTS5 Q9UNA0 2/20 0.40
▸ MAOA P21397 3/20 0.38
▸ MAOB P27338 3/20 0.38
▸ RECQL P46063 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ FGFR2 P21802 1/20 0.36
▸ MMP14 P50281 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ BCHE P06276 4/20 0.35
▸ ACHE P22303 4/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34

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
SCHEMBL3219573 0.85 MAOA (0.44) RAB9AMAPTNPC1ALDH1A1MAOA
SCHEMBL4956895 0.81 ALDH1A1 (0.46) HPGDRAB9AMAPTNPC1ALDH1A1
SCHEMBL7625779 0.80 MAOB (0.59) RAB9AMAPTNPC1ALDH1A1MAOA
SCHEMBL127279 0.74 RAB9A (0.77) HPGDRAB9AMAPTNPC1ALDH1A1
SCHEMBL427816 0.74 RAB9A (0.77) HPGDRAB9AMAPTNPC1ALDH1A1
SCHEMBL18118972 0.74 RAB9A (0.77) HPGDRAB9AMAPTNPC1ALDH1A1
SCHEMBL3138724 0.73 CA1 (0.47) HPGDRAB9AMAPTALDH1A1NPSR1
SCHEMBL13899281 0.73 ALDH1A1 (0.47) HPGDRAB9AMAPTNPC1ALDH1A1
SCHEMBL8918799 0.73 MAPT (0.39) HPGDRAB9AMAPTNPC1ALDH1A1
SCHEMBL1891502 0.73 NR1I2 (0.36) HPGDRAB9AMAPTNPC1ALDH1A1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2554392-B1 HEAT-SENSITIVE RECORDING MATERIAL AND METHOD FOR MANUFACTURING THE SAME MITSUBISHI PAPER MILLS LTD (JP) 2016-05-11 — — EP disclosed
US-8623785-B2 Thermal recording material and method for producing the same MITSUBISHI PAPER MILLS LIMITED (JP) 2014-01-07 — — US disclosed
US-20130053240-A1 THERMAL RECORDING MATERIAL AND METHOD FOR PRODUCING THE SAME MITSUBISHI PAPER MILLS LIMITED (JP) 2013-02-28 — — US disclosed
EP-2554392-A1 HEAT-SENSITIVE RECORDING MATERIAL AND METHOD FOR MANUFACTURING THE SAME Mitsubishi Paper Mills Limited (JP) 2013-02-06 — — EP disclosed
US-8183175-B2 Thermal recording material MITSUBISHI PAPER MILLS LIMITED (JP) 2012-05-22 — — US disclosed
US-20100062195-A1 Thermal recording material MITSUBISHI PAPER MILLS LIMITED (JP) 2010-03-11 — — US disclosed
US-20070026259-A1 Thermal recording material MITSUBISHI PAPER MILLS LIMITED (JP) 2007-02-01 — — US disclosed
US-5691272-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1997-11-25 — — US disclosed
US-5559247-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-24 — — US disclosed
EP-0679640-A1 Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-11-02 — — EP disclosed
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