SCHEMBL2885907

SCHEMBL2885907

Cc1nc2ccccc2n1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.55
MAPK1 P28482 1/20 0.55
TNF P01375 1/20 0.55
TSHR P16473 2/20 0.52
ALDH1A1 P00352 2/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.50
GALR3 O60755 3/20 0.50
NR2F2 P24468 3/20 0.50
LMNA P02545 3/20 0.50
RAB9A P51151 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TP53 P04637 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NPC1 O15118 1/20 0.47
ALDH3A1 P30838 2/20 0.46
PTPN2 P17706 1/20 0.46
PTPN1 P18031 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
SCHEMBL4176723 0.76 KDM4E (0.50) MAPK1ALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL353890 0.76 SMN1; SMN2 (0.63) HTTMAPK1TNFTSHRALDH1A1
SCHEMBL66294 0.76 SMN1; SMN2 (0.63) HTTMAPK1TNFKMT2ASMN1; SMN2
SCHEMBL10980166 0.75 NLRP3 (0.42) HTTALDH1A1KMT2ALMNARAB9A
SCHEMBL18347137 0.74 HTT (0.55) HTTMAPK1TNFTSHRALDH1A1
SCHEMBL8422526 0.74 HTT (0.55) HTTMAPK1TNFTSHRALDH1A1
Ammonia Solution, Strong SCHEMBL19182582 0.74 SMN1; SMN2 (0.61) HTTMAPK1TNFTSHRALDH1A1
Bromide SCHEMBL5318089 0.74 SMN1; SMN2 (0.61) HTTMAPK1TNFTSHRALDH1A1
SCHEMBL20143511 0.74 HTT (0.55) HTTMAPK1TNFTSHRALDH1A1
SCHEMBL13839193 0.74 HTT (0.55) HTTMAPK1TNFTSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
US-20090167156-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2009-07-02 US disclosed
US-20090167156-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2009-07-02 US disclosed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 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-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists HNMT, HRH4, HRH3 HTT 396/4885MAPK1 2465/4885TNF 4166/4885

“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.