SCHEMBL2905338

SCHEMBL2905338

CCC(=O)NCc1ccccc1Br

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.62
▸ KMT2A Q03164 3/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ P2RX7 Q99572 4/20 0.55
▸ MAPT P10636 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.51
▸ ANPEP P15144 1/20 0.50
▸ CA12 O43570 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ LMNA P02545 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ HTT P42858 1/20 0.46
▸ EPHX2 P34913 1/20 0.46

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
SCHEMBL30259906 1.00 RIPK1 (0.62) RIPK1KMT2ANPC1RAB9AP2RX7
SCHEMBL10150926 0.83 HTT (0.50) KMT2ANPC1RAB9AALDH1A1MEN1
SCHEMBL33530786 0.83 TAAR1 (0.56) RIPK1CA12CA1CA2CA9
SCHEMBL102342 0.81 RIPK1 (0.61) RIPK1KMT2ANPC1RAB9AP2RX7
SCHEMBL24242025 0.81 P2RX7 (0.54) RIPK1KMT2ANPC1RAB9AP2RX7
SCHEMBL24953453 0.81 EPHX2 (0.64) RIPK1KMT2AP2RX7MEN1HTT
SCHEMBL30259908 0.80 ALDH1A1 (0.64) KMT2ANPC1RAB9AP2RX7ALDH1A1
SCHEMBL13170238 0.80 ALDH1A1 (0.64) KMT2ANPC1RAB9AP2RX7ALDH1A1
SCHEMBL14944101 0.80 TSHR (0.53) MAPTCA12CA2CA9HTT
SCHEMBL2456852 0.79 KMT2A (0.58) RIPK1KMT2ANPC1RAB9AP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103130594-A Method preparing N-aryl and N-alkyl aromatic amine type compound from phenol type compound UNIV ZHEJIANG 2013-06-05 — — CN disclosed
EP-1586552-B1 PROCESS FOR PRODUCING BENZYLAMINE DERIVATIVE IHARA CHEMICAL IND CO (JP) 2010-08-25 — — EP disclosed
CN-100503551-C Process for producing benzylamine derivative IHARA CHEMICAL IND CO (JP) 2009-06-24 — — CN disclosed
US-7326813-B2 Process for producing benzylamine derivative IHARA CHEMICAL INDUSTRY (JP) 2008-02-05 — — US disclosed
US-20060155141-A1 Process for producing benzylamine derivative ITO AKINORI 2006-07-13 — — US disclosed
CN-1802343-A Process for producing benzylamine derivative IHARA CHEMICAL IND CO (JP) 2006-07-12 — — CN disclosed
EP-1586552-A1 PROCESS FOR PRODUCING BENZYLAMINE DERIVATIVE IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 2005-10-19 — — 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-20060155141-A1 Process for producing benzylamine derivative BRD7, BRD1, BRD2 RIPK1 4019/4885KMT2A 404/4885NPC1 3303/4885

“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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