SCHEMBL29756149

SCHEMBL29756149

CCCCOc1nc(Cl)c(N)c(N(Cc2ccc(OC)cc2)Cc2ccc(OC)cc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.42
USP2 O75604 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2D6 P10635 2/20 0.42
TSHR P16473 2/20 0.42
CYP2C9 P11712 1/20 0.42
APAF1 O14727 1/20 0.41
NR1I2 O75469 1/20 0.41
HSP90AA1 P07900 1/20 0.41
IDE P14735 1/20 0.41
UBE2N P61088 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
PKM P14618 1/20 0.40
ALDH1A1 P00352 3/20 0.39
TLR7 Q9NYK1 5/20 0.39
NOS1 P29475 1/20 0.39
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38

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
SCHEMBL24732837 1.00 LMNA (0.42) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL29809152 0.85 LMNA (0.41) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL24732688 0.85 LMNA (0.41) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL28393827 0.83 LMNA (0.40) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL28595576 0.83 LMNA (0.40) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL29756227 0.81 LMNA (0.39) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL24733060 0.81 TLR7 (0.40) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL29809070 0.81 TLR7 (0.40) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL27213608 0.81 LMNA (0.39) LMNAUSP2CYP1A2CYP2D6TSHR
SCHEMBL24732842 0.78 SMN1; SMN2 (0.40) LMNACYP1A2CYP2D6TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF INNOVSTONE THERAPEUTICS LIMITED (CN) 2024-05-09 US disclosed
CN-117736210-A Aromatic heterocyclic compound, and preparation method and application thereof 上海翊石医药科技有限公司 2024-03-22 CN disclosed
CN-114805341-B Aromatic heterocyclic compound, and preparation method and application thereof 上海翊石医药科技有限公司 2023-12-08 CN disclosed
CN-111065636-B Condensed heteroaryl derivatives, their preparation and their use in medicine 江苏恒瑞医药股份有限公司 2022-08-23 CN disclosed
WO-2022161420-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翊石医药科技有限公司 2022-08-04 WO disclosed
CN-114805341-A Aromatic heterocyclic compounds and preparation method and application thereof 上海翊石医药科技有限公司 2022-07-29 CN 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-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF TLR7, TLR1, TLR8 LMNA 1854/4885USP2 4109/4885CYP1A2 495/4885

“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.