SCHEMBL31614113

SCHEMBL31614113

O=[N+]([O-])c1c(F)ccc2ccncc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HASPIN Q8TF76 5/20 0.47
▸ GSK3B P49841 1/20 0.47
▸ HIPK2 Q9H2X6 2/20 0.41
▸ CLK1 P49759 2/20 0.40
▸ HTT P42858 4/20 0.39
▸ MAPT P10636 4/20 0.39
▸ LMNA P02545 1/20 0.39
▸ DAPK3 O43293 1/20 0.37
▸ PLK1 P53350 1/20 0.37
▸ PLK3 Q9H4B4 1/20 0.37
▸ PLK2 Q9NYY3 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ DYRK1A Q13627 1/20 0.36

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
SCHEMBL22445531 1.00 HASPIN (0.47) HASPINGSK3BHIPK2CLK1HTT
SCHEMBL2502319 0.87 HASPIN (0.54) HASPINGSK3BCLK1HTTMAPT
SCHEMBL8706865 0.80 ESR1 (0.48) HASPINGSK3BHIPK2CLK1HTT
SCHEMBL10923361 0.80 HASPIN (0.47) HASPINGSK3BHIPK2CLK1HTT
SCHEMBL11742334 0.80 HASPIN (0.44) HASPINGSK3BHIPK2CLK1HTT
SCHEMBL11738139 0.76 NCOA3 (0.44) HASPINGSK3BHIPK2CLK1HTT
SCHEMBL7936527 0.75 TSHR (0.62) HTTMAPTALDH1A1TSHRMEN1
SCHEMBL30308307 0.72 CLK1 (0.43) HIPK2CLK1HTTMAPTDYRK1A
SCHEMBL22094381 0.72 CLK1 (0.43) HIPK2CLK1HTTMAPTDYRK1A
SCHEMBL1351778 0.71 MAPT (0.56) HIPK2HTTMAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250188079-A1 INHIBITING CYCLIC AMP-RESPONSIVE ELEMENT-BINDING PROTEIN (CREB) FORMA THERAPEUTICS, INC. 2025-06-12 — — 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 (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-20250188079-A1 INHIBITING CYCLIC AMP-RESPONSIVE ELEMENT-BINDING PROTEIN (CREB) CREBBP, CREB1, EP300 HASPIN 1076/4885GSK3B 1541/4885HIPK2 154/4885

“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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