SCHEMBL2129113

SCHEMBL2129113

O=C(Nc1cccc(Cl)c1)c1cc2ccccc2cc1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 3/20 0.71
P2RX1 P51575 1/20 0.71
P2RX4 Q99571 1/20 0.71
P2RX7 Q99572 1/20 0.71
RAB9A P51151 6/20 0.64
POLB P06746 3/20 0.64
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
LMNA P02545 2/20 0.64
MAPT P10636 2/20 0.64
HTT P42858 2/20 0.64
MAOB P27338 1/20 0.64
TNF P01375 1/20 0.64
POLA1 P09884 1/20 0.64
THRB P10828 1/20 0.64
NOD1 Q9Y239 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
CBR1 P16152 1/20 0.63
AKR1C3 P42330 1/20 0.63
SRC P12931 1/20 0.62

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
SCHEMBL330715 0.88 TMPRSS4 (0.65) FADS1P2RX1P2RX4P2RX7RAB9A
SCHEMBL5631068 0.86 P2RX1 (0.77) FADS1P2RX1P2RX4P2RX7RAB9A
SCHEMBL29403111 0.85 NPC1 (0.73) P2RX1RAB9APOLBMEN1KMT2A
SCHEMBL11070985 0.85 SRC (0.83) RAB9APOLBMEN1KMT2ALMNA
SCHEMBL2743095 0.85 NPC1 (0.73) P2RX1RAB9APOLBMEN1KMT2A
SCHEMBL30637146 0.85 NPC1 (0.73) P2RX1RAB9APOLBMEN1KMT2A
SCHEMBL57970 0.84 MEN1 (0.77) RAB9APOLBMEN1KMT2ALMNA
SCHEMBL29890853 0.84 MEN1 (0.77) RAB9APOLBMEN1KMT2ALMNA
SCHEMBL30084384 0.84 MEN1 (0.77) RAB9APOLBMEN1KMT2ALMNA
SCHEMBL4738811 0.84 FADS1 (0.72) FADS1P2RX1P2RX4P2RX7RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202327-B2 Pigment composition, inkjet recording ink, coloring composition for color filter, and color filter FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-8202327-B2 Pigment composition, inkjet recording ink, coloring composition for color filter, and color filter FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 US disclosed
US-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 US disclosed
US-20120001133-A1 PIGMENT COMPOSITION, INKJET RECORDING INK, COLORING COMPOSITION FOR COLOR FILTER, AND COLOR FILTER FUJIFILM CORPORATION (JP) 2012-01-05 US disclosed
US-20120001133-A1 PIGMENT COMPOSITION, INKJET RECORDING INK, COLORING COMPOSITION FOR COLOR FILTER, AND COLOR FILTER FUJIFILM CORPORATION (JP) 2012-01-05 US disclosed
EP-2402404-A1 Pigment composition, inkjet recording ink, coloring composition for color filter, and color filter FUJIFILM Corporation (JP) 2012-01-04 EP disclosed
US-7989498-B2 Immunosuppressants; autoimmune disease; organs transplantation; antiinflammatory agents; viricides; antiproliferative agents; antitumor, anticancer agents VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-08-02 US disclosed
US-7989498-B2 Immunosuppressants; autoimmune disease; organs transplantation; antiinflammatory agents; viricides; antiproliferative agents; antitumor, anticancer agents VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-08-02 US disclosed
US-7915255-B2 Metabolism-modulating agents and uses therefor VERVA PHARMACEUTICALS PTY LTD (AU) 2011-03-29 US disclosed
US-7915255-B2 Metabolism-modulating agents and uses therefor VERVA PHARMACEUTICALS PTY LTD (AU) 2011-03-29 US disclosed
US-5459247-A Bisazo compounds useful as charge generating materials RICOH COMPANY, LTD. (JP) 1995-10-17 US disclosed
EP-0322586-B1 Photo-receptor for electrophotography KONISHIROKU PHOTO IND (JP) 1994-11-02 EP disclosed
US-5317093-A Disazo, fluorene dyes for electrography RICOH COMPANY, LTD. (JP) 1994-05-31 US disclosed
US-4939058-A Durability KONICA CORPORATION (JP) 1990-07-03 US disclosed
EP-0322586-A2 Photo-receptor for electrophotography KONICA CORPORATION (JP) 1989-07-05 EP disclosed
US-4307167-A REUSABLE PHOTOCONDUCTOR CONTAINING A CHARGE TRANSPORT LAYER AND A CHARGE GENERATION LAYER INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1981-12-22 US disclosed
US-4221709-A Azo pigments DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 1980-09-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 FADS1 551/4885P2RX1 4747/4885P2RX4 4720/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.