SCHEMBL6131273

SCHEMBL6131273

CCCC(=O)N(N)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.62
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
GLA P06280 1/20 0.46
TSHR P16473 1/20 0.46
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
LTB4R2 Q9NPC1 2/20 0.43
MEN1 O00255 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
JAK2 O60674 1/20 0.41
PAX8 Q06710 1/20 0.41
ALOX5 P09917 1/20 0.41

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
SCHEMBL27486724 0.89 LTB4R2 (0.50) TP53ALDH1A1KMT2ANPSR1NPC1
SCHEMBL5873285 0.88 ALDH1A1 (0.52) TP53ALDH1A1KMT2ANPSR1NPC1
SCHEMBL30810407 0.86 NPC1 (0.51) TP53ALDH1A1KMT2ANPC1RAB9A
SCHEMBL8131251 0.86 NPC1 (0.51) TP53ALDH1A1KMT2ANPC1RAB9A
SCHEMBL5458885 0.84 TP53 (0.67) TP53ALDH1A1KMT2ANPSR1NPC1
SCHEMBL3388559 0.84 ALDH1A1 (0.48) TP53ALDH1A1KMT2ANPSR1NPC1
SCHEMBL10878247 0.83 HSD17B3 (0.48) TP53ALDH1A1TSHRLTB4R2
SCHEMBL8954554 0.82 NPSR1 (0.47) TP53ALDH1A1KMT2ANPSR1NPC1
SCHEMBL109362 0.82 ALDH1A1 (0.47) TP53ALDH1A1KMT2ANPSR1NPC1
Hydrochloric Acid SCHEMBL5252881 0.82 TP53 (0.65) TP53ALDH1A1KMT2ANPSR1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118255685-A Tricyclic compound, pharmaceutical composition and application thereof 珂阑(上海)医药科技有限公司 2024-06-28 CN disclosed
WO-2021191219-A1 N-PHENYL-3-MERCAPTOPROPANAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS FOR THE TREATMENT OF BACTERIAL INFECTIONS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2021-09-30 WO disclosed
CN-105102486-A Nitrile group-containing copolymer rubber, crosslinkable rubber composition, and crosslinked rubber product ZEON CORP 2015-11-25 CN disclosed
EP-1295731-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 2005-11-23 EP disclosed
US-6869908-B2 Thermal recording material FUJI PHOTO FILM CO., LTD. (JP) 2005-03-22 US disclosed
US-6835522-B2 Multicolor; colorfastness; photostability FUJI PHOTO FILM CO., LTD. (JP) 2004-12-28 US disclosed
US-6815138-B2 COMPRISES MODIFIED POLYGLYCEROL LAYER AND DIAZO COUPLER; MICROCAPSULATION; IMPROVED COLOR DISPERSION, RADIATION TRANSPARENCY, AND GLOSSINESS FUJI PHOTO FILM CO., LTD. (JP) 2004-11-09 US disclosed
US-20030186808-A1 Thermal recording material FUJI PHOTO FILM CO., LTD. 2003-10-02 US disclosed
US-20030141491-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2003-07-31 US disclosed
US-20030114306-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2003-06-19 US disclosed
EP-1295731-A2 Heat-senstive recording material FUJI PHOTO FILM CO., LTD. (JP) 2003-03-26 EP disclosed
US-20020187417-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. 2002-12-12 US disclosed
EP-0941867-B1 Heat-sensitive recording material having a protective layer FUJI PHOTO FILM CO LTD (JP) 2001-09-05 EP disclosed
US-6197724-B1 DISPERSION STABILITY; UNIFORM IMAGE QUALITY; TRANSPARENCY, GLOSSINESS, AND LIGHT-FASTNESS CAN BE FORMED WITH HIGH COLOR-DEVELOPING SENSITIVITY FUJI PHOTO FILM CO., LTD. (JP) 2001-03-06 US disclosed
US-6034033-A SILICONE POLYMER AS PROTECTIVE COATING FUJI PHOTO FILM CO., LTD. (JP) 2000-03-07 US disclosed
EP-0941867-A1 Heat-sensitive recording material having a protective layer FUJI PHOTO FILM CO., LTD. (JP) 1999-09-15 EP disclosed
US-5679494-A PHOTOSTABILITY, FIXABILITY FUJI PHOTO FILM CO., LTD. (JP) 1997-10-21 US disclosed