SCHEMBL9557674

SCHEMBL9557674

CCN(C(=O)c1ccccc1)N(C(=O)c1ccccc1)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.49
▸ HPGD P15428 3/20 0.49
▸ PGR P06401 1/20 0.49
▸ ADRA2A P08913 1/20 0.49
▸ ADRA2B P18089 1/20 0.49
▸ HTR2A P28223 1/20 0.49
▸ HRH1 P35367 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ MAPT P10636 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HSD11B1 P28845 1/20 0.41
▸ MLYCD O95822 1/20 0.41
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TRPM8 Q7Z2W7 1/20 0.39
▸ CES2 O00748 1/20 0.39

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
SCHEMBL9558054 0.87 ALDH1A1 (0.46) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL9557549 0.87 ALDH1A1 (0.46) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL9557709 0.79 ALDH1A1 (0.49) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL9557425 0.79 TRPM8 (0.38) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL27579062 0.78 ALDH1A1 (0.55) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL9557948 0.77 HSD11B1 (0.49) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL1004615 0.77 NAMPT (0.55) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL8174284 0.74 ALDH1A1 (0.46) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL8180478 0.74 MLYCD (0.49) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL3183842 0.72 ALDH1A1 (0.49) ALDH1A1HPGDPGRADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5225443-A Lepidotera and Coleoptera insecticides to protect plants ROHM AND HAAS COMPANY (US) 1993-07-06 — — US disclosed
EP-0245950-B1 INSECTICIDAL N-SUBSTITUTED-N' - SUBSTITUTED-N, N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1992-06-17 — — EP disclosed
EP-0245950-A2 Insecticidal n-substituted-n' - substituted-n, n'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-11-19 — — EP disclosed
Send feedback