SCHEMBL10340692

SCHEMBL10340692

CCOC(=O)c1cnn(-c2cccc(CC)c2)c1Cl

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.64
ALDH1A1 P00352 8/20 0.54
HPGD P15428 2/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
KMT2A Q03164 1/20 0.54
RAB9A P51151 4/20 0.49
POLB P06746 2/20 0.49
NPC1 O15118 2/20 0.49
TP53 P04637 2/20 0.48
NPBWR1 P48145 2/20 0.48
TSHR P16473 1/20 0.47
MCHR1 Q99705 1/20 0.46

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
SCHEMBL27271892 0.92 HTT (0.64) HTTALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL10340603 0.90 HTT (0.78) HTTALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL10340550 0.89 HTT (0.65) HTTALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL3057553 0.86 ALDH1A1 (0.71) HTTALDH1A1HPGDSMN1; SMN2RAB9A
SCHEMBL10340640 0.85 HTT (0.78) HTTALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL10340595 0.83 HTT (0.56) HTTALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL16694907 0.81 HTT (0.54) HTTALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL6405411 0.81 ALDH1A1 (0.60) HTTALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL16479382 0.80 HTT (0.73) HTTALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL10513861 0.80 ALDH1A1 (0.55) HTTALDH1A1HPGDSMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1016398-B The pollen that contains pyrazole derivatives generates composite inhibiting ELLI LILLY & CO (US) 1992-04-29 CN disclosed
EP-0177242-B1 POLLEN FORMATION INHIBITING PYRAZOLES ELI LILLY AND COMPANY (US) 1990-01-03 EP disclosed
US-4775409-A PREVENTING POLLEN FORMATION ELI LILLY AND COMPANY (US) 1988-10-04 US disclosed
US-4666504-A HYBRIDS ELI LILLY AND COMPANY (US) 1987-05-19 US disclosed
CN-85107078-A The pollen that contains pyridine derivate generates composite inhibiting 1987-04-01 CN disclosed
EP-0177242-A2 Pollen formation inhibiting pyrazoles ELI LILLY AND COMPANY (US) 1986-04-09 EP disclosed