SCHEMBL19851469

SCHEMBL19851469

O=c1onc(Cc2ccc(I)cc2)o1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.31
▸ IDO1 P14902 1/20 0.31
▸ DAO P14920 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HTR2C P28335 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
SCHEMBL22554347 0.82 ESR1 (0.45) —
SCHEMBL22190335 0.81 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1
SCHEMBL22554349 0.78 ALDH1A1 (0.54) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL22554383 0.71 CA2 (0.54) MEN1KMT2ALMNATP53SMN1; SMN2
SCHEMBL30866427 0.71 CA2 (0.54) MEN1KMT2ALMNATP53SMN1; SMN2
SCHEMBL22554359 0.70 DAO (0.43) LMNACYP3A4DAO
SCHEMBL22554348 0.70 RAB9A (0.46) MEN1KMT2ALMNATP53SMN1; SMN2
SCHEMBL21121457 0.67 ESR1 (0.48) KMT2AALDH1A1
SCHEMBL21157240 0.67 ALDH1A1 (0.51) LMNADAOALDH1A1
SCHEMBL21157874 0.67 CYP1A2 (0.38) LMNATP53SMN1; SMN2DAOALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3271018-B1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PIMAVANSERIN PLIVA HRVATSKA D O O (HR) 2020-12-23 — — EP disclosed
US-10807953-B2 Processes and intermediates for the preparation of Pimavanserin PLIVA HRVATSKA D.O.O. (HR) 2020-10-20 — — US disclosed
US-20190276401-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PIMAVANSERIN PLIVA HRVATSKA D.O.O. (HR) 2019-09-12 — — US disclosed
US-10343993-B2 Processes and intermediates for the preparation of Pimavanserin PLIVA HRVATSKA D.O.O. (HR) 2019-07-09 — — US disclosed
US-20180037549-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PIMAVANSERIN TAPI CROATIA INDUSTRIES LTD (HR) 2018-02-08 — — 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 (4 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-10807953-B2 Processes and intermediates for the preparation of Pimavanserin PIM1, PIM3, PIM2 MEN1 3691/4885ELANE 4805/4885KMT2A 1480/4885
US-10343993-B2 Processes and intermediates for the preparation of Pimavanserin PIM1, PIM3, PIM2 MEN1 3691/4885ELANE 4805/4885KMT2A 1480/4885
US-20190276401-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PIMAVANSERIN PIM1, PIM3, PIM2 MEN1 3691/4885ELANE 4805/4885KMT2A 1480/4885
US-20180037549-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PIMAVANSERIN PIM1, PIM3, PIM2 MEN1 3691/4885ELANE 4805/4885KMT2A 1480/4885

“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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