SCHEMBL24701301

SCHEMBL24701301

C[C@@H](O)CNCc1ccc(-c2ccccc2)o1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.63
AMY1A P0DUB6 1/20 0.59
ALDH1A1 P00352 3/20 0.56
HSD17B10 Q99714 2/20 0.56
KDM4E B2RXH2 1/20 0.56
CYP2D6 P10635 3/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2A6 P11509 3/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2E1 P05181 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2B6 P20813 1/20 0.47
HTR6 P50406 3/20 0.46
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
HTR2A P28223 1/20 0.46
HTR7 P34969 1/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL24701004 1.00 HRH1 (0.63) HRH1AMY1AALDH1A1HSD17B10KDM4E
SCHEMBL19243567 1.00 HRH1 (0.63) HRH1AMY1AALDH1A1HSD17B10KDM4E
SCHEMBL24701173 0.85 HRH1 (0.55) HRH1AMY1AALDH1A1HSD17B10KDM4E
Hydrochloric Acid SCHEMBL11638310 0.84 HTT (0.57) HRH1AMY1AALDH1A1HSD17B10KDM4E
SCHEMBL24701134 0.84 CYP2A6 (0.72) HRH1AMY1AALDH1A1HSD17B10KDM4E
SCHEMBL24700851 0.84 CYP2A6 (0.72) HRH1AMY1AALDH1A1HSD17B10KDM4E
SCHEMBL28897283 0.79 HRH1 (0.63) HRH1ALDH1A1HSD17B10KDM4ECYP2D6
SCHEMBL11624978 0.79 HRH1 (0.58) HRH1AMY1AALDH1A1HSD17B10KDM4E
SCHEMBL24701104 0.76 HTR6 (0.56) HRH1ALDH1A1HSD17B10KDM4ECYP2D6
SCHEMBL24700981 0.75 ALDH1A1 (0.51) HRH1AMY1AALDH1A1HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402883-A1 COMPOUNDS AND METHODS FOR MODULATING RNA FUNCTION ARRAKIS THERAPEUTICS, INC. 2022-12-22 US disclosed
US-20220281860-A1 COMPOUNDS AND METHODS OF TREATING RNA-MEDIATED DISEASES ARRAKIS THERAPEUTICS, INC. 2022-09-08 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-20220281860-A1 COMPOUNDS AND METHODS OF TREATING RNA-MEDIATED DISEASES NSUN3, NSUN2, POLRMT HRH1 3727/4885AMY1A 3044/4885ALDH1A1 2596/4885
US-20220402883-A1 COMPOUNDS AND METHODS FOR MODULATING RNA FUNCTION NSUN3, NSUN2, METTL16 HRH1 4590/4885AMY1A 3335/4885ALDH1A1 3659/4885

“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.