SCHEMBL10025188

SCHEMBL10025188

Ic1ccc2c(c1)CC1=C2Cc2cc(I)ccc21

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 2/20 0.52
▸ PNMT P11086 6/20 0.42
▸ ADRA2A P08913 1/20 0.42
▸ ADRA2B P18089 1/20 0.42
▸ ADRA2C P18825 1/20 0.42
▸ ESR2 Q92731 10/20 0.38
▸ ESR1 P03372 9/20 0.38
▸ APP P05067 1/20 0.38
▸ NPC1 O15118 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RAB9A P51151 1/20 0.30

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
SCHEMBL481427 0.84 TDP2 (0.55) TDP2PNMTADRA2AADRA2BADRA2C
SCHEMBL481172 0.75 ALDH1A1 (0.59) TDP2ADRA2ANPC1MAPTRAB9A
SCHEMBL783721 0.74 TDP2 (0.45) TDP2PNMTADRA2AADRA2BADRA2C
SCHEMBL4891220 0.74 TDP2 (0.55) TDP2PNMTADRA2AADRA2BADRA2C
SCHEMBL23166405 0.73 TDP2 (0.46) TDP2PNMTADRA2AADRA2BADRA2C
SCHEMBL14346526 0.73 METAP1 (0.47) TDP2PNMTADRA2AADRA2BADRA2C
SCHEMBL21841861 0.73 TDP2 (0.46) TDP2PNMTADRA2AADRA2BADRA2C
SCHEMBL5525788 0.73 MAPT (0.62) TDP2PNMTADRA2AADRA2BADRA2C
SCHEMBL2137121 0.73 METAP1 (0.47) TDP2PNMTADRA2AADRA2BADRA2C
SCHEMBL18454733 0.70 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124964-B2 Field-effect transistor NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-02-28 — — US disclosed
US-20100032655-A1 Field-effect transistor NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-02-11 — — 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-20100032655-A1 Field-effect transistor CHRM1, TEAD1, XPO6 TDP2 3835/4885PNMT 739/4885ADRA2A 2977/4885

“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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