SCHEMBL2023318

SCHEMBL2023318

C=C(Cl)CSc1ccc(Br)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ KMT2A Q03164 4/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ MAOA P21397 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ MAOB P27338 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ STAT6 P42226 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
SCHEMBL4259433 0.81 HPGD (0.47) SMN1; SMN2KMT2AALDH1A1MEN1NPC1
SCHEMBL10959070 0.79 RAB9A (0.45) SMN1; SMN2KMT2AALDH1A1MEN1NPC1
SCHEMBL6824016 0.79 NPC1 (0.45) SMN1; SMN2KMT2AALDH1A1NPC1POLB
SCHEMBL10368187 0.79 SMN1; SMN2 (0.66) SMN1; SMN2KMT2AALDH1A1MEN1NPC1
SCHEMBL9732673 0.78 FFAR1 (0.56) SMN1; SMN2KMT2AALDH1A1MEN1NPC1
SCHEMBL2018934 0.77 MAOA (0.47) SMN1; SMN2KMT2AALDH1A1MAPTMAOA
SCHEMBL10963231 0.75 KDM4E (0.48) SMN1; SMN2KMT2AALDH1A1NPC1MAPT
SCHEMBL632287 0.72 SMN1; SMN2 (0.68) SMN1; SMN2KMT2AALDH1A1MEN1NPC1
SCHEMBL27175355 0.72 GAA (0.39) KMT2AALDH1A1MEN1NPC1POLB
SCHEMBL1741704 0.71 SMN1; SMN2 (0.45) SMN1; SMN2KMT2AALDH1A1MEN1NPC1

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-20130065897-A1 COMPOUNDS, PREPARATION AND USES THEREOF PETER MACCALLUM CANCER INSTITUTE (AU) 2013-03-14 — — US disclosed
EP-2515903-A1 COMPOUNDS, PREPARATIONS AND USES THEREOF Peter MacCallum Cancer Institute (AU) 2012-10-31 — — EP disclosed
WO-2011075784-A1 COMPOUNDS, PREPARATIONS AND USES THEREOF PETER MACCALLUM CANCER INSTITUTE (AU) 2011-06-30 — — 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-20130065897-A1 COMPOUNDS, PREPARATION AND USES THEREOF PRF1, GZMB, SERPINB1 SMN1; SMN2 921/4885KMT2A 4859/4885ALDH1A1 3531/4885

“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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