SCHEMBL21091997

SCHEMBL21091997

CNC(=O)/C(=C/c1ccccc1)NC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
TSHR P16473 1/20 0.48
AKR1C3 P42330 1/20 0.48
RECQL P46063 1/20 0.46
MAPT P10636 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
DHODH Q02127 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
NPC1 O15118 1/20 0.42
AKR1C1 Q04828 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
SCHEMBL1070872 0.86 AKR1C3 (0.55) ALDH1A1TSHRAKR1C3RECQLMAPT
SCHEMBL13879068 0.86 AKR1C3 (0.55) ALDH1A1TSHRAKR1C3RECQLMAPT
SCHEMBL14003229 0.84 RECQL (0.55) ALDH1A1TSHRAKR1C3RECQLMAPT
SCHEMBL14003231 0.84 RECQL (0.55) ALDH1A1TSHRAKR1C3RECQLMAPT
SCHEMBL22263074 0.83 KMT2A (0.59) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL22263078 0.83 KMT2A (0.59) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL20610671 0.82 MCL1 (0.49) ALDH1A1TSHRAKR1C3RECQLMAPT
SCHEMBL976606 0.80 AKR1C3 (0.64) ALDH1A1TSHRAKR1C3RECQLMAPT
SCHEMBL976605 0.80 AKR1C3 (0.64) ALDH1A1TSHRAKR1C3RECQLMAPT
SCHEMBL27542414 0.79 ALDH1A1 (0.42) ALDH1A1TSHRAKR1C3RECQLMAPT

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-10851086-B2 Polycrystalline form of dehydrophenylahistin-like compound, and manufacturing and purification method and application thereof MARINE BIOMEDICAL RESEARCH INSTITUTE OF QINGDAO CO., LTD. (CN) 2020-12-01 US disclosed
US-20190177302-A1 POLYCRYSTALLINE FORM OF DEHYDROPHENYLAHISTIN-LIKE COMPOUND, AND MANUFACTURING AND PURIFICATION METHOD AND APPLICATION THEREOF SHENZHEN HUAHONG MARINE BIOMEDICINE CO., LTD (CN) 2019-06-13 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 (2 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-10851086-B2 Polycrystalline form of dehydrophenylahistin-like compound, and manufacturing and purification method and application thereof DHPS, HDHD5, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ALDH1A1 3153/4885TSHR 964/4885AKR1C3 2709/4885
US-20190177302-A1 POLYCRYSTALLINE FORM OF DEHYDROPHENYLAHISTIN-LIKE COMPOUND, AND MANUFACTURING AND PURIFICATION METHOD AND APPLICATION THEREOF DHPS, HDHD5, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ALDH1A1 3153/4885TSHR 964/4885AKR1C3 2709/4885

“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.