SCHEMBL10107366

SCHEMBL10107366

c1ccc(CC2CCN(c3ccccn3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 3/20 0.55
SMN1; SMN2 Q16637 4/20 0.54
KDM4E B2RXH2 1/20 0.54
TSHR P16473 2/20 0.54
POLB P06746 1/20 0.54
CCR3 P51677 2/20 0.53
CHI3L1 P36222 1/20 0.52
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
HTT P42858 2/20 0.50
LMNA P02545 2/20 0.50
STAT3 P40763 2/20 0.50
PLD1 Q13393 1/20 0.50
NPC1 O15118 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TNF P01375 1/20 0.49
NOD2 Q9HC29 1/20 0.49
NOD1 Q9Y239 1/20 0.49
SMO Q99835 1/20 0.49

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
SCHEMBL8119586 0.84 TSHR (0.64) SMN1; SMN2KDM4ETSHRCCR3ALDH1A1
SCHEMBL8326977 0.81 PLD1 (0.57) AVPR1ASMN1; SMN2KDM4ETSHRALDH1A1
SCHEMBL26627827 0.81 PLD1 (0.53) AVPR1ASMN1; SMN2KDM4ECHI3L1ALDH1A1
SCHEMBL1145748 0.81 PLD1 (0.53) AVPR1AKDM4EALDH1A1MAPTPLD1
SCHEMBL4764379 0.81 PLD1 (0.53) AVPR1AKDM4EPOLBALDH1A1MAPT
SCHEMBL3323867 0.80 SMN1; SMN2 (0.54) SMN1; SMN2TSHRCCR3ALDH1A1MAPT
Ammonia Solution, Strong SCHEMBL4429607 0.79 KDM4E (0.55) AVPR1AKDM4EALDH1A1MAPTPLD1
Hydrochloric Acid SCHEMBL121616 0.79 PLD1 (0.51) AVPR1AKDM4EALDH1A1MAPTPLD1
SCHEMBL13622621 0.79 ALDH1A1 (0.62) AVPR1ASMN1; SMN2KDM4EALDH1A1L3MBTL1
SCHEMBL4429602 0.78 DRD2 (0.51) AVPR1AKDM4EALDH1A1MAPTPLD1

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-8101768-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2012-01-24 US disclosed
US-7485727-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2009-02-03 US disclosed
US-20080319003-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-12-25 US disclosed
US-20080045569-A1 Cyclic Amine Compound and Pest Control Agent NIPPON SODA CO., LTD. (JP) 2008-02-21 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 (2 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-20080045569-A1 Cyclic Amine Compound and Pest Control Agent H1-0, H1-2, H1-4 AVPR1A 356/4885SMN1; SMN2 2535/4885KDM4E 373/4885
US-20080319003-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT H1-0, H1-2, H1-4 AVPR1A 364/4885SMN1; SMN2 2482/4885KDM4E 339/4885

“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.