SCHEMBL24136160

SCHEMBL24136160

COc1cccc2c1cc(C)n2I

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.39
NQO2 P16083 2/20 0.38
CYP19A1 P11511 1/20 0.38
HTR6 P50406 2/20 0.38
NQO1 P15559 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
TNFRSF1A P19438 1/20 0.36
MTNR1B P49286 3/20 0.36
MTNR1A P48039 2/20 0.36
CCR2 P41597 1/20 0.36
GAA P10253 1/20 0.36
FNTA P49354 1/20 0.35
PGGT1B P53609 1/20 0.35
DAO P14920 1/20 0.35

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
SCHEMBL434299 0.84 CYP19A1 (0.46) HTR2CNQO2CYP19A1HTR6NQO1
SCHEMBL24136216 0.77 CYP1A2 (0.42) HTR2CNQO2CA1CA2CA7
SCHEMBL24136211 0.77 IMPDH2 (0.39) HTR2CHTR6NQO1TNFRSF1AMTNR1B
SCHEMBL30547718 0.76 CCR2 (0.54) HTR6CA12CA1CA2CA7
SCHEMBL24136214 0.74 ALDH1A1 (0.32) NQO2KDM4EALDH1A1HSD17B10
SCHEMBL24136196 0.74 ERN1 (0.33) ALDH1A1HPGD
SCHEMBL25134418 0.73 CNR2 (0.48) HTR2CMTNR1BMTNR1ACCR2GAA
SCHEMBL20505464 0.72 HTR2C (0.43) HTR2CNQO2CYP19A1HTR6MTNR1B
SCHEMBL24136199 0.71 HTR2A (0.43) HTR2CNQO2CYP19A1NQO1CA12
SCHEMBL2157047 0.71 MAPK1 (0.58) CYP19A1MTNR1BMTNR1ACCR2ALDH1A1

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-20230312481-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF ARBUTUS BIOPHARMA CORP (CA) 2023-10-05 US disclosed
EP-3928836-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS PGE2 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2021-12-29 EP 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-20230312481-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF NSD3, PML, NSD1 HTR2C 3730/4885NQO2 1723/4885CYP19A1 3760/4885

“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.