SCHEMBL30319366

SCHEMBL30319366

C[C@@H](NCCCO)c1nn(C)c(=O)c2cc(F)c(F)cc12

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.35
▸ KAT2B Q92831 5/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.34
▸ LMNA P02545 3/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ HTT P42858 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ DHODH Q02127 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ P2RX3 P56373 1/20 0.31

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
SCHEMBL30319367 0.82 KAT2B (0.35) MAPTKAT2BSMN1; SMN2LMNACYP2D6
SCHEMBL30319349 0.79 LMNA (0.35) MAPTKAT2BSMN1; SMN2LMNACYP2D6
Hydrochloric Acid SCHEMBL30319352 0.78 LMNA (0.34) MAPTKAT2BSMN1; SMN2LMNACYP2D6
Hydrochloric Acid SCHEMBL30319329 0.78 LMNA (0.34) MAPTKAT2BSMN1; SMN2LMNACYP2D6
SCHEMBL22094913 0.77 DHODH (0.33) SMN1; SMN2DHODH
SCHEMBL30319308 0.71 KAT2B (0.31) KAT2BSMN1; SMN2LMNADHODH
SCHEMBL30319343 0.70 ROCK1 (0.41) MAPTSMN1; SMN2LMNACYP2D6HTT
SCHEMBL30595733 0.70 LMNA (0.36) MAPTKAT2BSMN1; SMN2LMNACYP2D6
SCHEMBL22094176 0.68 RRM1 (0.30) —
SCHEMBL30595736 0.67 LMNA (0.36) MAPTKAT2BSMN1; SMN2LMNACYP2D6

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-4161905-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF Arbutus Biopharma Corporation (CA) 2023-04-12 — — 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 MAPT 484/4885KAT2B 1530/4885SMN1; SMN2 3828/4885

“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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