SCHEMBL4970018

SCHEMBL4970018

Cc1ncccc1C(=O)CCl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.59
LMNA P02545 6/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 7/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MITF O75030 1/20 0.42
KMT2A Q03164 1/20 0.42
CTNNB1 P35222 1/20 0.41
WNT3A P56704 1/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTT P42858 2/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MYC P01106 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 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
Hydrochloric Acid SCHEMBL7996665 0.98 P2RX7 (0.57) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL7454565 0.84 P2RX7 (0.54) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL2632669 0.83 P2RX7 (0.61) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL6077799 0.81 P2RX7 (0.64) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL2231066 0.81 P2RX7 (0.59) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL11808999 0.80 P2RX7 (0.62) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
Bromide SCHEMBL15753399 0.80 P2RX7 (0.57) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL9696312 0.79 ALDH1A1 (0.50) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL11621763 0.79 P2RX7 (0.56) P2RX7LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL724087 0.79 P2RX7 (0.65) P2RX7LMNASMN1; SMN2ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240390298-A1 CYCLOHEXYL BETA-HYDROXY ALKYL AMINES AND MEDICAL USES THEREOF ATROGI AB (SE) 2024-11-28 US disclosed
EP-4405041-A1 CYCLOHEXYL BETA-HYDROXY ALKYL AMINES AND MEDICAL USES THEREOF Atrogi AB (SE) 2024-07-31 EP disclosed
CN-118265691-A Cyclohexylbeta-hydroxyalkylamines and their medical use 阿托基公司 2024-06-28 CN disclosed
WO-2023046882-A1 CYCLOHEXYL BETA-HYDROXY ALKYL AMINES AND MEDICAL USES THEREOF ATROGI AB (SE) 2023-03-30 WO disclosed
US-7384947-B2 Fused tricyclic heterocycles useful for treating hyper-proliferative disorders BAYER HEALTHCARE LLC (US) 2008-06-10 US disclosed
WO-2007002126-A1 ALKYL SULFONAMIDE DERIVATIVES H. LUNDBECK A/S (DK) 2007-01-04 WO disclosed
US-20060293341-A1 Alkyl sulfonamide derivatives H. LUNDBECK A/S (DK) 2006-12-28 US disclosed
US-20060287387-A1 Fused tricyclic heterocycles useful for treating hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2006-12-21 US disclosed
US-7144885-B2 Fused tricyclic heterocycles useful for treating hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2006-12-05 US disclosed
US-20050165042-A1 Fused tricyclic heterocycles useful for treating hyper-proliferative disoroders BAYER HEALTHCARE LLC 2005-07-28 US disclosed
EP-1478639-A1 FUSED TRICYCLIC HETEROCYCLES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS Bayer Pharmaceuticals Corporation (US) 2004-11-24 EP disclosed
WO-2003072566-A1 FUSED TRICYCLIC HETEROCYCLES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2003-09-04 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 (4 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-20240390298-A1 CYCLOHEXYL BETA-HYDROXY ALKYL AMINES AND MEDICAL USES THEREOF H1-5, CYP3A5, HRH3 P2RX7 674/4885LMNA 554/4885SMN1; SMN2 2479/4885
US-20060293341-A1 Alkyl sulfonamide derivatives NPY5R, NPY1R, NPY4R P2RX7 103/4885LMNA 3300/4885SMN1; SMN2 1478/4885
US-20060287387-A1 Fused tricyclic heterocycles useful for treating hyper-proliferative disorders MKI67, CCNA2, CDK4 P2RX7 4446/4885LMNA 2255/4885SMN1; SMN2 3112/4885
US-20050165042-A1 Fused tricyclic heterocycles useful for treating hyper-proliferative disoroders MKI67, CCNI, PCNA P2RX7 4291/4885LMNA 2773/4885SMN1; SMN2 3790/4885

“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.