SCHEMBL21652285

SCHEMBL21652285

CC(C)(C)c1ccc(Oc2ncc(C(F)(F)F)cc2Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.65
SMN1; SMN2 Q16637 6/20 0.65
RAB9A P51151 1/20 0.64
ALDH1A1 P00352 3/20 0.60
HTT P42858 3/20 0.59
HPGD P15428 3/20 0.59
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C19 P33261 1/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
MAPT P10636 2/20 0.57
LIPE Q05469 1/20 0.57
POLB P06746 1/20 0.57
XBP1 P17861 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
FFAR1 O14842 1/20 0.55

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
SCHEMBL11360493 0.91 SMN1; SMN2 (0.71) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL9790809 0.88 LMNA (0.67) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL12585076 0.87 LMNA (0.64) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL11459158 0.87 SMN1; SMN2 (0.66) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL2711491 0.84 SMN1; SMN2 (0.65) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL31251923 0.84 RAB9A (0.73) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL11196331 0.84 SMN1; SMN2 (0.67) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL5687596 0.84 RAB9A (0.73) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL10440879 0.84 RAB9A (0.72) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL6901995 0.83 SMN1; SMN2 (0.64) LMNASMN1; SMN2RAB9AALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10544092-B2 Malononitrile oxime ether compound and use thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2020-01-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10544092-B2 Malononitrile oxime ether compound and use thereof ME1, MAL2, ME3 LMNA 4658/4885SMN1; SMN2 1799/4885RAB9A 4007/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.