SCHEMBL20032475

SCHEMBL20032475

CCC(CC)c1ccc(-c2ccc(OCC(C)C)cc2)cc1-n1ccc(C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MDM2 Q00987 2/20 0.35
MCL1 Q07820 2/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 3/20 0.35
RAB9A P51151 3/20 0.35
GAA P10253 2/20 0.35
HPGD P15428 2/20 0.35
POLB P06746 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPC1 O15118 2/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
AAK1 Q2M2I8 1/20 0.34
CTSA P10619 1/20 0.34

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
SCHEMBL20032487 0.91 PKM (0.41) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL21366797 0.88 CYP19A1 (0.37) NPSR1KDM4EALDH1A1MAPTRAB9A
SCHEMBL18713621 0.87 MAPT (0.38) MEN1KMT2AMDM2MCL1KDM4E
SCHEMBL20032473 0.86 DYRK1A (0.40) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL20032479 0.86 KDM4E (0.35) KDM4EALDH1A1MAPTRAB9AGAA
SCHEMBL16574200 0.85 MAPT (0.39) NPSR1MEN1KMT2AMDM2MCL1
SCHEMBL21366761 0.84 PKM (0.39) NPSR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL20032437 0.83 RAB9A (0.42) KDM4EALDH1A1MAPTRAB9AGAA
SCHEMBL18713753 0.83 PKM (0.41) NPSR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL18713977 0.81 RAB9A (0.40) KDM4EALDH1A1MAPTRAB9AGAA

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-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ROIVANT SCIENCES GMBH (CH) 2021-03-16 US disclosed
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ROIVANT SCIENCES GMBH (CH) 2020-07-30 US disclosed
US-10660893-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ROIVANT SCIENCES, GmbH (CH) 2020-05-26 US disclosed
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2019-09-19 US disclosed
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2018-04-05 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 (5 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-10660893-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A NPSR1 205/4885MEN1 629/4885KMT2A 1610/4885
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A NPSR1 205/4885MEN1 629/4885KMT2A 1610/4885
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A NPSR1 205/4885MEN1 629/4885KMT2A 1610/4885
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A NPSR1 205/4885MEN1 629/4885KMT2A 1610/4885
US-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A NPSR1 205/4885MEN1 629/4885KMT2A 1610/4885

“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.