SCHEMBL558755

SCHEMBL558755

COc1cccc2cnc(Cl)nc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MCHR1 Q99705 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
TYK2 P29597 1/20 0.48
JAK3 P52333 1/20 0.48
HPGDS O60760 2/20 0.46
NQO2 P16083 5/20 0.46
PIN1 Q13526 1/20 0.44
PDE10A Q9Y233 1/20 0.44
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
G6PD P11413 1/20 0.40
PKM P14618 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 SCHEMBL28039648 0.98 ALDH1A1 (0.49) ALDH1A1KDM4EMCHR1SMN1; SMN2JAK2
SCHEMBL18181668 0.85 ALK (0.46) ALDH1A1KDM4ESMN1; SMN2NQO2PIN1
SCHEMBL7747283 0.80 MCHR1 (0.51) ALDH1A1MCHR1JAK2JAK1TYK2
SCHEMBL18181674 0.79 ALK (0.47) ALDH1A1KDM4ESMN1; SMN2HPGDS
SCHEMBL18181671 0.79 ALK (0.45) ALDH1A1KDM4ESMN1; SMN2JAK2JAK3
SCHEMBL1039857 0.79 MCHR1 (0.59) ALDH1A1KDM4EMCHR1JAK2JAK1
SCHEMBL13313220 0.79 MCHR1 (0.50) ALDH1A1MCHR1SMN1; SMN2JAK2JAK1
SCHEMBL1633206 0.79 HPGDS (0.50) ALDH1A1KDM4EMCHR1JAK2JAK1
SCHEMBL31172952 0.78 PIN1 (0.47) ALDH1A1KDM4ESMN1; SMN2PIN1NPC1
SCHEMBL13439479 0.77 MCHR1 (0.49) ALDH1A1KDM4EMCHR1SMN1; SMN2JAK2

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 62 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119968360-A Quinazoline compound and application thereof 赛诺哈勃药业(成都)有限公司 2025-05-09 CN disclosed
US-20250092017-A1 2-PIPERIDYL OR 2-PYRAZOLYL SUBSTITUTED PYRIMIDINE COMPOUND SERVING AS EGFR INHIBITOR Suzhou Puhe BioPharma Co., Ltd. (CN) 2025-03-20 US disclosed
EP-4450495-A1 2-PIPERIDYL OR 2-PYRAZOLYL SUBSTITUTED PYRIMIDINE COMPOUND SERVING AS EGFR INHIBITOR Suzhou Puhe Biopharma Co., Ltd. (CN) 2024-10-23 EP disclosed
WO-2024131938-A1 QUINAZOLINE COMPOUND AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2024-06-27 WO disclosed
WO-2023161844-A1 USE OF HPK1 INHIBITOR IN TREATMENT OF INTERFERON-RELATED DISEASES 智宠制药(北京)有限公司 2023-08-31 WO disclosed
WO-2023143135-A1 QUINAZOLINE DERIVATIVE AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2023-08-03 WO disclosed
CN-116514728-A Quinazoline derivative and application thereof 赛诺哈勃药业(成都)有限公司 2023-08-01 CN disclosed
CN-116478136-A 2-piperidinyl or 2-pyrazolyl substituted pyrimidine compounds as EGFR inhibitors 苏州浦合医药科技有限公司 2023-07-25 CN disclosed
WO-2023134266-A1 2-PIPERIDYL OR 2-PYRAZOLYL SUBSTITUTED PYRIMIDINE COMPOUND SERVING AS EGFR INHIBITOR 苏州浦合医药科技有限公司 2023-07-20 WO disclosed
WO-2023134266-A1 2-PIPERIDYL OR 2-PYRAZOLYL SUBSTITUTED PYRIMIDINE COMPOUND SERVING AS EGFR INHIBITOR 苏州浦合医药科技有限公司 2023-07-20 WO disclosed
EP-1558585-A4 NEUROLOGICALLY-ACTIVE COMPOUNDS PRANA BIOTECHNOLOGY LTD (AU) 2008-07-02 EP disclosed
WO-2007117607-A9 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS VACCINES & DIAGNOSTIC (US) 2008-03-06 WO disclosed
WO-2007117607-A9 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS VACCINES & DIAGNOSTIC (US) 2008-03-06 WO disclosed
WO-2007125405-A2 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-08 WO disclosed
WO-2007125405-A2 SUBSTITUTED 2-AMINO-FUSED HETEROCYCLIC COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-08 WO disclosed
WO-2007117607-A2 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS AG (CH) 2007-10-18 WO disclosed
WO-2007117607-A2 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS AG (CH) 2007-10-18 WO disclosed
US-20060167000-A1 Neurologically-active compounds PRANA BIOTECHNOLOGY LIMITED (AU) 2006-07-27 US disclosed
EP-1558585-A1 NEUROLOGICALLY-ACTIVE COMPOUNDS Prana Biotechnology Ltd (AU) 2005-08-03 EP disclosed
WO-2004031161-A1 NEUROLOGICALLY-ACTIVE COMPOUNDS PRANA BIOTECHNOLOGY LIMITED (AU) 2004-04-15 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 (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-20250092017-A1 2-PIPERIDYL OR 2-PYRAZOLYL SUBSTITUTED PYRIMIDINE COMPOUND SERVING AS EGFR INHIBITOR EGFR, ERBB2, ERBB4 ALDH1A1 3675/4885KDM4E 4442/4885MCHR1 4458/4885
US-20060167000-A1 Neurologically-active compounds ACHE, PSEN1, PSEN2 ALDH1A1 634/4885KDM4E 3333/4885MCHR1 4112/4885

“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.