SCHEMBL1927457

SCHEMBL1927457

O=C(NCc1cccc2ccccc12)c1cccc(-c2ccc(F)cc2)c1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CSNK1D P48730 1/20 0.55
▸ CHRNB2 P17787 1/20 0.54
▸ CHRNA4 P43681 1/20 0.54
▸ AURKA O14965 1/20 0.54
▸ EPHX2 P34913 2/20 0.53
▸ NR1H4 Q96RI1 1/20 0.53
▸ CA2 P00918 1/20 0.52
▸ KMT2A Q03164 1/20 0.49
▸ CFD P00746 1/20 0.49
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ KAT6A Q92794 1/20 0.48
▸ ADORA2A P29274 1/20 0.47
▸ ADORA1 P30542 1/20 0.47
▸ HASPIN Q8TF76 1/20 0.47

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
SCHEMBL1928101 0.91 CHRNB2 (0.64) CSNK1DCHRNB2CHRNA4EPHX2NR1H4
SCHEMBL3817884 0.80 CA2 (0.70) CHRNB2CHRNA4CA2KMT2ACYP1A2
SCHEMBL3767060 0.78 CA2 (0.61) CSNK1DCHRNB2CHRNA4CA2KMT2A
SCHEMBL1927790 0.78 CA2 (0.57) CSNK1DCHRNB2CHRNA4CA2KMT2A
SCHEMBL3773526 0.78 CA2 (0.61) CSNK1DCHRNB2CHRNA4CA2KMT2A
SCHEMBL8350912 0.76 CSNK1D (0.53) CSNK1DCHRNB2CHRNA4EPHX2NR1H4
SCHEMBL26119946 0.75 HPGD (0.69) AURKAEPHX2NR1H4KMT2ACFD
SCHEMBL14082490 0.75 CYP2C9 (0.65) CSNK1DCHRNB2CHRNA4CA2PKM
SCHEMBL3771548 0.74 BCHE (0.68) CHRNB2CHRNA4CA2KMT2AMAPT
SCHEMBL14180101 0.74 MCHR1 (0.60) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1763509-B1 ALPHA-HELICAL MIMETICS WALTER & ELIZA HALL INST MEDICAL RES (AU) 2018-02-21 — — EP disclosed
US-7956216-B2 Benzoyl urea derivatives mimicing BH3-only proteins, able to interact with a Bcl-2 protein THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2011-06-07 — — US disclosed
US-20080153802-A1 Alpha-helical mimetics THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2008-06-26 — — US disclosed
EP-1763509-A1 ALPHA-HELICAL MIMETICS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2007-03-21 — — EP disclosed
WO-2006002474-A1 ALPHA-HELICAL MIMETICS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2006-01-12 — — 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-20080153802-A1 Alpha-helical mimetics BID, BAX, BAD CSNK1D 2158/4885CHRNB2 3564/4885CHRNA4 4576/4885

“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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