SCHEMBL19851593

SCHEMBL19851593

O=C(Cc1ccc(I)cc1)NO

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 6/20 0.63
HDAC6 Q9UBN7 4/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
KDM4E B2RXH2 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
PDE4A P27815 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HIF1A Q16665 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC1 Q13547 5/20 0.50
SIGMAR1 Q99720 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44

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
SCHEMBL18307178 0.81 LMNA (0.47) HDAC8HDAC6MEN1KMT2AKDM4E
SCHEMBL27658745 0.81 AOC2 (0.56) HDAC8HDAC6MEN1KMT2ACYP1A2
SCHEMBL12688085 0.80 HDAC8 (0.65) HDAC8HDAC6MEN1KMT2AKDM4E
SCHEMBL14820608 0.78 HDAC6 (0.63) HDAC8HDAC6MEN1KMT2AKDM4E
SCHEMBL6184682 0.78 MEN1 (0.63) HDAC8HDAC6MEN1KMT2ASMN1; SMN2
SCHEMBL12938972 0.78 KMT2A (0.63) HDAC8HDAC6MEN1KMT2AKDM4E
SCHEMBL15522678 0.78 HDAC1 (0.74) HDAC8HDAC6MEN1KMT2AKDM4E
SCHEMBL27485540 0.78 GAA (0.66) HDAC8HDAC6MEN1KMT2AKDM4E
Phenylacetohydroxamic Acid SCHEMBL213873 0.77 HDAC8 (1.00) HDAC8HDAC6MEN1KMT2AHDAC10
SCHEMBL211138 0.77 HDAC8 (0.67) HDAC8HDAC6MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 HDAC8 3762/4885HDAC6 3692/4885MEN1 3691/4885
US-10343993-B2 Processes and intermediates for the preparation of Pimavanserin PIM1, PIM3, PIM2 HDAC8 3762/4885HDAC6 3692/4885MEN1 3691/4885
US-20190276401-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PIMAVANSERIN PIM1, PIM3, PIM2 HDAC8 3762/4885HDAC6 3692/4885MEN1 3691/4885
US-20180037549-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF PIMAVANSERIN PIM1, PIM3, PIM2 HDAC8 3762/4885HDAC6 3692/4885MEN1 3691/4885

“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.