SCHEMBL29548932

SCHEMBL29548932

S=C=Nc1c2ccccc2nc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
HPGD P15428 4/20 0.47
MAOA P21397 3/20 0.47
HSD17B10 Q99714 3/20 0.47
ADRA2A P08913 2/20 0.47
ADORA3 P0DMS8 2/20 0.47
DRD1 P21728 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
CYP1A2 P05177 2/20 0.47
ABCB11 O95342 1/20 0.47
NR3C1 P04150 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
ADRA2C P18825 1/20 0.47
SLC6A4 P31645 1/20 0.47
HTR2B P41595 1/20 0.47
CCR2 P41597 1/20 0.47
MIF P14174 1/20 0.46
KDM4E B2RXH2 5/20 0.45
GLA P06280 3/20 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
SCHEMBL135810 1.00 ALDH1A1 (0.47) ALDH1A1HPGDMAOAHSD17B10ADRA2A
Acridine SCHEMBL2317889 0.91 ALDH1A1 (0.52) ALDH1A1HPGDMAOAHSD17B10ADRA2A
SCHEMBL4580940 0.79 KDM4E (0.45) ALDH1A1HPGDMAOAHSD17B10ADRA2A
SCHEMBL28193792 0.71 ALDH1A1 (0.50) ALDH1A1HPGDMAOAHSD17B10ADRA2A
SCHEMBL2066411 0.71 KDM4E (0.50) ALDH1A1HPGDMAOAHSD17B10ADRA2A
SCHEMBL37656 0.71 ALDH1A1 (0.61) ALDH1A1HPGDMAOAHSD17B10ADRA2A
SCHEMBL3289579 0.71 ALDH1A1 (0.46) ALDH1A1HPGDMAOAHSD17B10ADRA2A
SCHEMBL18396131 0.68 ALDH1A1 (0.52) ALDH1A1HPGDMAOAHSD17B10ADRA2A
SCHEMBL15624393 0.68 KDM4E (0.52) ALDH1A1HPGDMAOAHSD17B10ADRA2A
SCHEMBL18396133 0.68 ALDH1A1 (0.52) ALDH1A1HPGDMAOAHSD17B10ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4436364-A1 TOBRFV-TOLERANT OR RESISTANT PLANTS AND METHODS OF PRODUCING SAME The State of Israel, Ministry of Agriculture & Rural Development, Agricultural Research Organization (ARO) (Volcani Institute) (IL) 2024-10-02 EP disclosed
EP-4423502-A1 EXONUCLEASE-COUPLED REAL-TIME ENDONUCLEASE ACTIVITY ASSAY Caribou Biosciences, Inc. (US) 2024-09-04 EP disclosed
EP-4337198-A1 POLO LIKE KINASE 4 INHIBITORS Oric Pharmaceuticals, Inc. (US) 2024-03-20 EP disclosed
WO-2024026336-A2 METHODS AND REAGENTS FOR DETECTION, QUANTITATION, AND GENOTYPING OF EPSTEIN-BARR VIRUS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2024-02-01 WO disclosed
WO-2023230321-A1 MACHINE LEARNING SYSTEMS AND METHODS FOR GENE SET ENRICHMENT ANALYSIS AND SCORING COFACTOR GENOMICS, INC. (US) 2023-11-30 WO disclosed
EP-4244251-A1 METHODS, SYSTEMS, AND KITS FOR TREATMENT OF INFLAMMATORY DISEASES TARGETING TL1A Prometheus Biosciences, Inc. (US) 2023-09-20 EP disclosed
WO-2023157007-A1 KITS AND METHODS FOR SELECTING EUCALYPTUS GENOTYPES RESISTANT TO PHYSIOLOGICAL DISTURBANCE FUTURAGENE ISRAEL LTD. (IL) 2023-08-24 WO disclosed
WO-2023095144-A1 FTOBRFV-TOLERANT OR RESISTANT PLANTS AND METHODS OF PRODUCING SAME THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI INSTITUTE) (IL) 2023-06-01 WO disclosed
WO-2023076857-A1 EXONUCLEASE-COUPLED REAL-TIME ENDONUCLEASE ACTIVITY ASSAY CARIBOU BIOSCIENCES, INC. (US) 2023-05-04 WO disclosed
WO-2023055955-A1 PATIENT CENTRIC PRECISION MODEL FOR ANTI-TNF THERAPY PROMETHEUS LABORATORIES INC. (US) 2023-04-06 WO disclosed
WO-2023044501-A2 METHODS FOR TREATING A SUBTYPE OF COLORECTAL CANCER CORNELL UNIVERSITY (US) 2023-03-23 WO disclosed
WO-2022240876-A1 POLO LIKE KINASE 4 INHIBITORS ORIC PHARMACEUTICALS, INC. (US) 2022-11-17 WO disclosed
EP-4055180-A1 METHODS AND SYSTEMS OF PROCESSING COMPLEX DATA SETS USING ARTIFICIAL INTELLIGENCE AND DECONVOLUTION Cofactor Genomics, Inc. (US) 2022-09-14 EP disclosed
WO-2022103961-A1 METHODS, SYSTEMS, AND KITS FOR TREATMENT OF INFLAMMATORY DISEASES TARGETING TL1A PROMETHEUS BIOSCIENCES, INC. (US) 2022-05-19 WO disclosed