SCHEMBL24119876

SCHEMBL24119876

CCN(C(=O)c1ccc(OC(F)(F)F)cc1)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 3/20 0.46
▸ HDAC3 O15379 1/20 0.46
▸ HDAC1 Q13547 1/20 0.46
▸ HDAC2 Q92769 1/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ MCHR1 Q99705 1/20 0.44
▸ SLC6A2 P23975 2/20 0.44
▸ SLC6A4 P31645 2/20 0.44
▸ NAMPT P43490 1/20 0.43
▸ FASN P49327 1/20 0.42
▸ EPHX2 P34913 2/20 0.42
▸ NR1H4 Q96RI1 1/20 0.42
▸ EPHX1 P07099 1/20 0.42
▸ MLYCD O95822 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ PPARA Q07869 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ TRPV1 Q8NER1 1/20 0.42

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
SCHEMBL27316581 0.82 FASN (0.43) HRH3MEN1KMT2ASLC6A2SLC6A4
SCHEMBL3874936 0.81 NPSR1 (0.48) HRH3HDAC3HDAC1HDAC2MEN1
SCHEMBL12086361 0.81 MLYCD (0.63) HRH3HDAC3HDAC1HDAC2MEN1
SCHEMBL13035442 0.80 HDAC4 (0.49) HRH3HDAC3HDAC1HDAC2MEN1
SCHEMBL24119999 0.78 HRH3 (0.48) HRH3HDAC3HDAC1HDAC2MEN1
SCHEMBL14518807 0.78 SLC6A2 (0.48) HRH3HDAC3HDAC1HDAC2MEN1
SCHEMBL13058340 0.78 SLC6A2 (0.48) HRH3HDAC3HDAC1HDAC2MEN1
SCHEMBL2599660 0.76 SMN1; SMN2 (0.63) HDAC3HDAC1HDAC2MEN1KMT2A
SCHEMBL11757172 0.75 MLYCD (0.52) HRH3HDAC3HDAC1HDAC2MEN1
SCHEMBL25870883 0.74 NAMPT (0.49) HDAC1MEN1KMT2ANAMPTFASN

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-20210395243-A1 PESTICIDAL COMPOUNDS BASF SE (DE) 2021-12-23 — — 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-20210395243-A1 PESTICIDAL COMPOUNDS NIT2, PNMT, DDT HRH3 2656/4885HDAC3 2587/4885HDAC1 2876/4885

“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.

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