SCHEMBL8100877

SCHEMBL8100877

O=c1c2ccccc2nc2ccc(Cl)nn12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 10/20 0.56
NPC1 O15118 7/20 0.56
RAB9A P51151 6/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALDH1A1 P00352 5/20 0.52
MITF O75030 1/20 0.52
PKM P14618 1/20 0.52
KDM4E B2RXH2 6/20 0.50
HSD17B10 Q99714 2/20 0.50
POLB P06746 2/20 0.50
HTT P42858 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50

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
SCHEMBL9306694 0.78 SMN1; SMN2 (0.53) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL11385268 0.77 SMN1; SMN2 (0.52) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL28351868 0.74 KDM4E (0.61) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL11389959 0.74 SMN1; SMN2 (0.50) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL9307318 0.73 KDM4E (0.56) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL3037601 0.69 AKT1 (0.68) SMN1; SMN2MEN1KMT2AHPGDMAPK1
SCHEMBL18337079 0.69 KDM4E (0.47) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL8262886 0.68 ALDH1A1 (0.45) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL1241457 0.68 ALDH1A1 (0.41) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL28679155 0.67 SMN1; SMN2 (0.64) SMN1; SMN2MEN1KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-55053205-A None JP disclosed
US-6150375-A INHIBITORS OF BOTH OF THE HUMAN 5AR ISOZYMES; BENIGN PROSTATE HYPERPLASIA, MALE PATTERN BALDNESS, ACNE VULGARIS, SEBORRHEA, ANDROGENIC ALOPECIA, HIRSUTISM AND PROSTATE CANCER; BLOCKS THE CONVERSION OF TESTOSTERONE TO 5-ALPHA-DIHYDROTESTOSTERONE ELI LILLY AND COMPANY (US) 2000-11-21 US disclosed
US-5670514-A BENZOQUINOLIN-3-ONE ELI LILLY AND COMPANY (US) 1997-09-23 US disclosed
US-5635197-A BENZO(F)QUINOLIN-3-ONES; ANTICARCINOGENIC AGENTS; BONE DISORDERS ELI LILLY AND COMPANY (US) 1997-06-03 US disclosed
US-5629007-A USING BENZOQUINOLIN-3-ONE DERIVATIVES ELI LILLY AND COMPANY (US) 1997-05-13 US disclosed
US-5622961-A PROSTATE CANCER, SKIN DISORDERS, BALDNESS ELI LILLY AND COMPANY (US) 1997-04-22 US disclosed
US-5622962-A PROSTATE CANCER, SKIN DISORDERS, BALDNESS ELI LILLY AND COMPANY (US) 1997-04-22 US disclosed
US-5578724-A INHIBITORS OF 5-ALPHA-REDUCTASE ELI LILLY AND COMPANY (US) 1996-11-26 US disclosed
EP-0742010-A2 Benzoquinolin-3-ones to inhibit bone loss ELI LILLY AND COMPANY (US) 1996-11-13 EP disclosed
EP-0733365-A2 Use of benzoquinolin-3-ones for the treatment and prevention of prostatic cancer ELI LILLY AND COMPANY (US) 1996-09-25 EP disclosed
US-5550134-A ADMINISTERING TO A MAMMAL FROM A SERIES OF BENZOQUINOLIN-3-ONE COMPOUNDS ELI LILLY AND COMPANY (US) 1996-08-27 US disclosed
US-4256483-A 2-Alkoxy pyridazinoquinazolinone derivatives as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-03-17 US disclosed
JP-S5553205-A HERBICIDE COMPOSED OF SUBSTITUTED PYRIDAZINOQUINAZOLINONE DERIVATIVE SUMITOMO CHEM CO LTD 1980-04-18 JP disclosed