SCHEMBL23801792

SCHEMBL23801792

CCn1c2ccc(C(=O)CCC3CCCC3)cc2c2cc(C(=O)c3ccc(O)cc3)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 2/20 0.45
THRB P10828 1/20 0.45
ACHE P22303 5/20 0.43
BCHE P06276 2/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43
TUBB6 Q9BUF5 1/20 0.43
TUBB2B Q9BVA1 1/20 0.43

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
SCHEMBL25515693 0.89 CNR2 (0.44) KMT2AMEN1ALDH1A1THRBACHE
SCHEMBL23802426 0.89 TUBB4A (0.44) KMT2AMEN1ALDH1A1THRBTUBB4A
SCHEMBL23802440 0.85 CNR2 (0.48) KMT2AMEN1ALDH1A1THRBACHE
SCHEMBL25515459 0.85 HSD17B3 (0.55) KMT2AMEN1ALDH1A1TUBB4ATUBB
SCHEMBL21610323 0.84 NPC1 (0.53) KMT2AMEN1ALDH1A1ACHEBCHE
SCHEMBL29620221 0.83 ACHE (0.47) KMT2AMEN1ALDH1A1THRBACHE
SCHEMBL29689936 0.83 ACHE (0.47) KMT2AMEN1ALDH1A1THRBACHE
SCHEMBL852418 0.83 ACHE (0.47) KMT2AMEN1ALDH1A1THRBACHE
SCHEMBL22534544 0.83 CNR2 (0.46) KMT2AMEN1ALDH1A1THRBACHE
SCHEMBL21610317 0.83 ALDH1A1 (0.45) KMT2AMEN1ALDH1A1THRBACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230142648-A1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2023-05-11 US disclosed
US-20230142648-A1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2023-05-11 US disclosed
WO-2021175855-A1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2021-09-10 WO 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-20230142648-A1 OXIME ESTER PHOTOINITIATORS OCIAD1, OCIAD2, OXER1 KMT2A 3437/4885MEN1 4834/4885ALDH1A1 964/4885

“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.