SCHEMBL8529985

SCHEMBL8529985

CCCc1ccc2c(c1)CCN2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50
ALDH1A1 P00352 3/20 0.43
ALOX15 P16050 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
THRB P10828 1/20 0.43
CASP1 P29466 1/20 0.43
HTT P42858 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HTR2C P28335 3/20 0.42
HTR2B P41595 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
NISCH Q9Y2I1 1/20 0.39
HTR1D P28221 1/20 0.39

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
SCHEMBL10911695 0.90 KDM4E (0.55) DRD2DRD4ALDH1A1ALOX15GAA
SCHEMBL11524478 0.90 DRD2 (0.47) DRD2DRD4ALDH1A1ALOX15GAA
SCHEMBL27610237 0.88 DRD2 (0.46) DRD2DRD4ALDH1A1ALOX15GAA
SCHEMBL565857 0.87 DRD2 (0.45) DRD2DRD4ALDH1A1KDM4ELMNA
SCHEMBL4190017 0.86 SMN1; SMN2 (0.51) DRD2DRD4HTR2CHTR2BSMN1; SMN2
SCHEMBL395752 0.85 DRD2 (0.53) DRD2DRD4ALDH1A1ALOX15GAA
SCHEMBL5536336 0.82 DRD2 (0.50) DRD2DRD4ALDH1A1ALOX15GAA
SCHEMBL27388262 0.81 DRD2 (0.46) DRD2DRD4ALDH1A1ALOX15MAPT
SCHEMBL13056751 0.81 DRD2 (0.42) DRD2DRD4ALDH1A1ALOX15GAA
SCHEMBL12324805 0.81 DRD2 (0.57) DRD2DRD4ALDH1A1ALOX15GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220135560-A1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF CLUES THERAPEUTICS (SHANGHAI) LTD (CN) 2022-05-05 US disclosed
US-5834494-A SEROTONIN 5HT2B/2C RECEPTOR ANTAGONISTS; CNS NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS; IRRITABLE BOWEL SYNDROME SMITHKLINE BEECHAM P.L.C. (GB) 1998-11-10 US disclosed
EP-0707581-B1 INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-02-26 EP disclosed
EP-0707581-A1 INDOLINE DERIVATIVES AS 5HT 2C? ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1996-04-24 EP disclosed
WO-1995001976-A1 INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-01-19 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-20220135560-A1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF RET, RIN1, WEE1 DRD2 4359/4885DRD4 4272/4885ALDH1A1 1030/4885

“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.