SCHEMBL23123793

SCHEMBL23123793

CC(C)C(=O)N1CCN(c2cccc(N)c2N)CC1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
NPSR1 Q6W5P4 7/20 0.53
GLA P06280 2/20 0.53
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 7/20 0.49
LMNA P02545 5/20 0.49
HTT P42858 2/20 0.49
HPGD P15428 1/20 0.49
ATM Q13315 1/20 0.47
USP2 O75604 1/20 0.46
MCHR1 Q99705 1/20 0.45
MAPT P10636 1/20 0.44

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
SCHEMBL29795506 1.00 TSHR (0.53) TSHRNPSR1GLACYP1A2CYP3A4
SCHEMBL23124284 0.83 ALDH1A1 (0.60) TSHRNPSR1CYP1A2CYP3A4CYP2D6
SCHEMBL29795641 0.83 ALDH1A1 (0.60) TSHRNPSR1CYP1A2CYP3A4CYP2D6
SCHEMBL23123428 0.81 ALDH1A1 (0.55) TSHRNPSR1GLACYP1A2CYP3A4
SCHEMBL4710630 0.79 MAPT (0.51) TSHRNPSR1CYP1A2CYP2C9CYP2C19
SCHEMBL1249642 0.77 SMARCA2 (0.55) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL31152780 0.77 SMARCA2 (0.55) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL21776417 0.77 TSHR (0.60) TSHRNPSR1GLAKMT2AMEN1
SCHEMBL16054013 0.76 ADRA2C (0.47) TSHRCYP3A4CYP2D6KMT2AMEN1
SCHEMBL13417638 0.76 SMN1; SMN2 (0.63) TSHRNPSR1GLACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220380319-A1 SUBSTITUTED BENZIMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-01 US disclosed
CN-114787136-A Substituted benzimidazole carboxamides and their use in the treatment of medical disorders 比亚尔R&D投资股份公司 2022-07-22 CN disclosed
WO-2021055591-A1 SUBSTITUTED BENZIMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL-BioTech Investments, Inc. (US) 2021-03-25 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-20220380319-A1 SUBSTITUTED BENZIMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GAA, GBA1, CLN6 TSHR 4510/4885NPSR1 3974/4885GLA 156/4885

“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.