SCHEMBL1574437

SCHEMBL1574437

O=C(CCBr)c1cc2ccccc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.59
HDAC3 O15379 2/20 0.56
HDAC4 P56524 2/20 0.56
HDAC1 Q13547 2/20 0.56
HDAC7 Q8WUI4 2/20 0.56
HDAC2 Q92769 2/20 0.56
HDAC10 Q969S8 2/20 0.56
HDAC11 Q96DB2 2/20 0.56
HDAC8 Q9BY41 2/20 0.56
HDAC6 Q9UBN7 2/20 0.56
HDAC9 Q9UKV0 2/20 0.56
HDAC5 Q9UQL6 2/20 0.56
SLC9A1 P19634 2/20 0.50
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
DYRK1A Q13627 1/20 0.49
RAB9A P51151 1/20 0.48
HRH4 Q9H3N8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TMIGD3 P0DMS9 1/20 0.44

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
SCHEMBL4526358 0.89 BCL2L1 (0.54) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL7384635 0.88 BCL2L1 (0.53) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL231135 0.86 BCL2L1 (0.62) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL11575531 0.85 BCL2L1 (0.61) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL10784071 0.83 BCL2L1 (0.59) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL11232455 0.83 BCL2L1 (0.64) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL12123735 0.83 BCL2L1 (0.59) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL15979641 0.82 BCL2L1 (0.62) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8537206 0.82 BCL2L1 (0.57) BCL2L1HDAC3HDAC4HDAC1HDAC7
SCHEMBL28118458 0.81 BCL2L1 (0.65) BCL2L1HDAC3HDAC4HDAC1HDAC7

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-8618133-B2 Aralkyl alcohol pyridine derivative compounds and the use thereof as medicaments for treating depression JIANGSU HENGYI PHARMACEUTICAL CO., LTD. (CN) 2013-12-31 US disclosed
US-20110160247-A1 Aralkyl alcohol piperidine derivative and the use thereof as a medicament for treating depression JIANGSU GOWORTH INVESTMENT CO. LTD (CN) 2011-06-30 US disclosed
EP-2305644-A1 ARALKYL ALCOHOL PIPERIDINE DERIVATIVE AND THE USE AS MEDICAMENT FOR TREATING DEPRESSION THEREOF Jiangsu Goworth Investment Co. Ltd (CN) 2011-04-06 EP 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-20110160247-A1 Aralkyl alcohol piperidine derivative and the use thereof as a medicament for treating depression DRD4, DRD5, DRD3 BCL2L1 811/4885HDAC3 937/4885HDAC4 364/4885

“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.