SCHEMBL7598485

SCHEMBL7598485

Cc1ccc2cc(/C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)/C(=C\C3CCN(Cc4ccccc4)CC3)c3cc4ccc(C)cc4n3S(=O)(=O)c3ccccc3)n(S(=O)(=O)c3ccccc3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
ALOX5 P09917 1/20 0.41
POLB P06746 1/20 0.41
NOD2 Q9HC29 1/20 0.41
NOD1 Q9Y239 1/20 0.41
HTR2A P28223 1/20 0.41
HTR6 P50406 1/20 0.41
DRD2 P14416 1/20 0.40
CCR4 P51679 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL7598488 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1LMNATSHRALOX5
SCHEMBL7598492 0.84 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1LMNATSHRALOX5
SCHEMBL251631 0.84 ACHE (0.53) SMN1; SMN2DRD2
SCHEMBL9387794 0.82 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1LMNATSHRALOX5
SCHEMBL7591567 0.81 SIGMAR1 (0.44) NOD2NOD1
SCHEMBL7591571 0.81 SIGMAR1 (0.44) NOD2NOD1
SCHEMBL7865669 0.79 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1LMNATSHRPOLB
SCHEMBL7594215 0.79 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1LMNATSHRPOLB
SCHEMBL7594219 0.78 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1LMNATSHRPOLB
SCHEMBL5336401 0.76 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1LMNATSHRHTR2A

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
US-20020049210-A1 Heteroaryl amines as novel acetylcholinesterase inhibitors CHEN YUHPYNG L (US) 2002-04-25 US disclosed
US-6303633-B1 FOR THERAPY AND PROPHYLAXIS OF ALZHEIMER'S DISEASE PFIZER INC 2001-10-16 US disclosed
US-6124321-A Heteroaryl amines as novel acetyl cholinesterase inhibitors PFIZER INC (US) 2000-09-26 US disclosed
US-5965574-A Heteroaryl amines as novel acetylcholinesterase inhibitors CHEN YUHPYNG LIANG (US) 1999-10-12 US disclosed
US-5574046-A Heteroaryl amines as novel acetylcholinesterase inhibitors PFIZER INC. (US) 1996-11-12 US disclosed
EP-0606248-A1 HETEROARYL AMINES AS NOVEL ACETYL CHOLINESTERASE INHIBITORS Eisai Co., Ltd. (JP) 1994-07-20 EP disclosed
WO-1993007140-A1 HETEROARYL AMINES AS NOVEL ACETYL CHOLINESTERASE INHIBITORS PFIZER INC. (US) 1993-04-15 WO 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-20020049210-A1 Heteroaryl amines as novel acetylcholinesterase inhibitors ACHE, BCHE, CHAT SMN1; SMN2 2799/4885ALDH1A1 1418/4885LMNA 3516/4885

“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.