SCHEMBL9501732

SCHEMBL9501732

CCCCCNc1ccc(O)c(N)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.49
NAAA Q02083 1/20 0.43
ALDH1A1 P00352 5/20 0.42
EGFR P00533 2/20 0.42
ALOX5 P09917 2/20 0.42
PTGS2 P35354 2/20 0.42
SYK P43405 1/20 0.42
HPGD P15428 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
HSP90AA1 P07900 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP3 P42574 1/20 0.41
HTT P42858 1/20 0.41
CDK9 P50750 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
SCHEMBL7132126 0.87 ABL1 (0.49) ABL1NAAAALDH1A1EGFRALOX5
SCHEMBL7951728 0.85 ABL1 (0.51) ABL1NAAAALDH1A1EGFRALOX5
SCHEMBL9484979 0.83 ABL1 (0.55) ABL1NAAAALDH1A1EGFRALOX5
SCHEMBL29578255 0.83 ABL1 (0.55) ABL1ALDH1A1KCNH3GPR84PRSS1
SCHEMBL9650900 0.81 ABL1 (0.50) ABL1NAAAALDH1A1EGFRALOX5
SCHEMBL11638268 0.80 ABL1 (0.65) ABL1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL29262271 0.80 ABL1 (0.53) ABL1ALDH1A1HTTKCNH3TDP1
SCHEMBL19145089 0.79 ARG1 (0.52) ABL1NAAAALDH1A1ALOX5PTGS2
SCHEMBL6229918 0.79 ALDH1A1 (0.41) ALDH1A1EGFRHPGDKDM4EMEN1
SCHEMBL2446050 0.79 ABL1 (0.68) ABL1ALDH1A1MEN1KMT2ASMN1; SMN2

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
EP-0285109-A1 Process for the preparation of 2-amino-4-acylamino-phenyl ether CIBA-GEIGY AG (CH) 1988-10-05 EP claimed
EP-0165564-B1 PROCESS FOR THE PREPARATION OF 4-ACYLAMINO-2-ALKYLAMINOPHENYL ETHERS HOECHST AKTIENGESELLSCHAFT (DE) 1988-05-25 EP claimed
EP-0165564-A2 Process for the preparation of 4-acylamino-2-alkylaminophenyl ethers HOECHST AKTIENGESELLSCHAFT (DE) 1985-12-27 EP claimed
EP-0007738-B1 PROCESS FOR PRODUCING 2-AMINO-4-ACYLAMINOPHENYL ETHER AND 2,4-DIAMINOPHENYL ETHER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-12-29 EP claimed
EP-0328968-B1 PROCESS FOR THE PREPARATION OF 4-ACYLAMINO-2-AMINO ALKOXY BENZENES HOECHST AKTIENGESELLSCHAFT (DE) 1993-05-12 EP disclosed
EP-0285109-B1 PROCESS FOR THE PREPARATION OF 2-AMINO-4-ACYLAMINO-PHENYL ETHER CIBA-GEIGY AG (CH) 1992-09-16 EP disclosed
EP-0328968-A2 Process for the preparation of 4-acylamino-2-amino alkoxy benzenes HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-23 EP disclosed
EP-0285109-A1 Process for the preparation of 2-amino-4-acylamino-phenyl ether CIBA-GEIGY AG (CH) 1988-10-05 EP disclosed
EP-0165564-B1 PROCESS FOR THE PREPARATION OF 4-ACYLAMINO-2-ALKYLAMINOPHENYL ETHERS HOECHST AKTIENGESELLSCHAFT (DE) 1988-05-25 EP disclosed
EP-0165564-A2 Process for the preparation of 4-acylamino-2-alkylaminophenyl ethers HOECHST AKTIENGESELLSCHAFT (DE) 1985-12-27 EP disclosed
EP-0165564-A2 Process for the preparation of 4-acylamino-2-alkylaminophenyl ethers HOECHST AKTIENGESELLSCHAFT (DE) 1985-12-27 EP disclosed
EP-0007738-B1 PROCESS FOR PRODUCING 2-AMINO-4-ACYLAMINOPHENYL ETHER AND 2,4-DIAMINOPHENYL ETHER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-12-29 EP disclosed
EP-0007738-A1 Process for producing 2-amino-4-acylaminophenyl ether and 2,4-diaminophenyl ether SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-02-06 EP disclosed