SCHEMBL23928865

SCHEMBL23928865

O=C(O)n1c(C(F)F)cc2cc(Br)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.46
OXER1 Q8TDS5 1/20 0.39
PIM1 P11309 1/20 0.35
FABP4 P15090 2/20 0.35
HDAC8 Q9BY41 1/20 0.34
NTSR1 P30989 1/20 0.34
FABP3 P05413 1/20 0.33
FABP2 P12104 1/20 0.33
FABP5 Q01469 1/20 0.33
KMO O15229 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GPR35 Q9HC97 1/20 0.33
DNMT1 P26358 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL31020833 0.81 NR1H2 (0.42) MCL1
SCHEMBL23928870 0.81 NR1H2 (0.42) MCL1
SCHEMBL27617524 0.77 MCL1 (0.66) MCL1OXER1PIM1FABP4FABP3
SCHEMBL19211743 0.77 MCL1 (0.53) MCL1OXER1PIM1FABP4NTSR1
SCHEMBL23928881 0.74 MCL1 (0.46) MCL1OXER1PIM1FABP4HDAC8
SCHEMBL1399465 0.73 MCL1 (0.49) MCL1OXER1PIM1FABP4NTSR1
SCHEMBL31404142 0.70 HSD17B10 (0.49) HTR2AHTR2CKDM4ERXFP1
SCHEMBL17674054 0.67 KDM4E (0.49) MCL1FABP4KDM4ERXFP1
SCHEMBL17022649 0.67 MCL1 (0.49) MCL1OXER1FABP4FABP3FABP2
SCHEMBL20275841 0.66 PDGFRA (0.44) MCL1KMOKDM4EGLAPRNP

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
EP-3820869-B1 SPIROCHROMANE DERIVATIVES RICHTER GEDEON NYRT (HU) 2023-08-30 EP disclosed
US-20210330650-A1 SPIROCHROMANE DERIVATIVES RICHTER GEDEON NYRT. (HU) 2021-10-28 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-20210330650-A1 SPIROCHROMANE DERIVATIVES CHRNA7, CHRM3, ADRB3 MCL1 4771/4885OXER1 59/4885PIM1 4848/4885

“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.