SCHEMBL682765

SCHEMBL682765

CCN(CC)CCn1c(-c2ccc(C(F)(F)F)cc2)nc2c1c(=O)n(C)c(=O)n2C

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.49
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
ADORA2A P29274 3/20 0.44
ADORA2B P29275 3/20 0.44
MAOA P21397 1/20 0.44
ADORA3 P0DMS8 1/20 0.42
ADORA1 P30542 1/20 0.42
POLB P06746 1/20 0.41
OPRK1 P41145 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL683888 0.88 SMN1; SMN2 (0.51) MAOBALDH1A1ADORA2AADORA2BTP53
Hydrochloric Acid SCHEMBL11381649 0.87 SMN1; SMN2 (0.50) MAOBALDH1A1ADORA2AADORA2BTP53
SCHEMBL684271 0.86 TSHR (0.54) MAOBALDH1A1ADORA2AADORA2BMAOA
SCHEMBL683962 0.85 ADORA2B (0.62) MAOBALDH1A1ADORA2AADORA2B
Hydrochloric Acid SCHEMBL11384998 0.85 TSHR (0.53) MAOBALDH1A1ADORA2AADORA2BMAOA
Hydrochloric Acid SCHEMBL11388923 0.84 ADORA2B (0.61) MAOBALDH1A1ADORA2AADORA2B
SCHEMBL683542 0.84 NCOA3 (0.54) MAOBALDH1A1ADORA2AADORA2BADORA3
Hydrochloric Acid SCHEMBL11381068 0.83 NCOA3 (0.53) MAOBALDH1A1ADORA2AADORA2BADORA3
SCHEMBL682759 0.81 SMN1; SMN2 (0.53) MAOBALDH1A1ADORA2AADORA2BADORA1
SCHEMBL7034529 0.81 ADORA2B (0.55) MAOBKDM4EALDH1A1ADORA2BPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 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-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF MAOB 808/4885KDM4E 2527/4885ALDH1A1 1565/4885

“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.