SCHEMBL24415464

SCHEMBL24415464

C1=CCC(OCCOc2ccccc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.42
TAAR1 Q96RJ0 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RECQL P46063 1/20 0.39
PKM P14618 3/20 0.38
MAOB P27338 2/20 0.36
MAOA P21397 1/20 0.36
TMEM97 Q5BJF2 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36

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
SCHEMBL29986014 0.81 KCNA3 (0.50) KCNA3TAAR1ALDH1A1RECQLPKM
SCHEMBL11798011 0.80 ALDH1A1 (0.34) ALDH1A1NPC1
SCHEMBL8335852 0.80 HPGD (0.51) KCNA3TAAR1ALDH1A1RECQLPKM
Ethylene SCHEMBL27549601 0.78 HPGD (0.47) KCNA3TAAR1ALDH1A1RECQLPKM
SCHEMBL15602733 0.75 CTSL (0.46) TMEM97SIGMAR1
SCHEMBL14627806 0.75 CTSL (0.46) TMEM97SIGMAR1
SCHEMBL5280272 0.73 MAOB (0.44) KCNA3ALDH1A1MAOBMAOAHTR1D
SCHEMBL13810637 0.71 TDP1 (0.46) ALDH1A1DRD2DRD4SMN1; SMN2
SCHEMBL5514779 0.71 ALDH1A1 (0.47) KCNA3TAAR1ALDH1A1RECQLPKM
SCHEMBL5521307 0.71 TAAR1 (0.47) KCNA3TAAR1ALDH1A1RECQLPKM

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-20220144759-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-05-12 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-20220144759-A1 COMPOUND SFXN3, SFXN1, CBR3 KCNA3 599/4885TAAR1 2255/4885ALDH1A1 1450/4885

“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.