SCHEMBL5999227

SCHEMBL5999227

O=C(O)C1=C(Br)N(c2ccccc2)CN1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ LMNA P02545 1/20 0.41
▸ FPR1 P21462 1/20 0.38
▸ CNR2 P34972 3/20 0.38
▸ FAAH O00519 1/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ P2RX7 Q99572 2/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34

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
SCHEMBL5999404 0.85 ALDH1A1 (0.40) ALDH1A1LMNAFPR1CNR2FAAH
SCHEMBL5999113 0.72 ALDH1A1 (0.41) ALDH1A1LMNAFPR1CNR2FAAH
SCHEMBL1077288 0.65 MAPK1 (0.40) ALDH1A1FPR1CNR2TSHRMAPK1
Hydrochloric Acid SCHEMBL1077516 0.63 SMN1; SMN2 (0.39) ALDH1A1FPR1CNR2TSHRMAPK1
SCHEMBL5999177 0.62 ALDH1A1 (0.39) ALDH1A1LMNAFPR1CNR2FAAH
SCHEMBL17476011 0.60 LMNA (0.47) ALDH1A1LMNATSHRMAPK1SMN1; SMN2
SCHEMBL1073193 0.60 ALDH1A1 (0.56) ALDH1A1LMNAFPR1MAPK1SMN1; SMN2
SCHEMBL2998694 0.58 FPR1 (0.38) ALDH1A1LMNAFPR1TSHRMAPK1
SCHEMBL2998699 0.58 FPR1 (0.38) ALDH1A1LMNAFPR1TSHRMAPK1
SCHEMBL2386636 0.57 USP2 (0.51) ALDH1A1LMNATSHRSMN1; SMN2MEN1

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
US-8937184-B2 1H-imidazole derivatives as cannabinoid CB2 receptor modulators ABBVIE B.V. (NL) 2015-01-20 — — US disclosed
US-20060194779-A1 1H-imidazole derivatives as cannabinoid CB2 receptor modulators ABBVIE B.V. (NL) 2006-08-31 — — 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-20060194779-A1 1H-imidazole derivatives as cannabinoid CB2 receptor modulators CNR1, CNR2, HRH4 ALDH1A1 1715/4885LMNA 3868/4885FPR1 1546/4885

“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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