SCHEMBL20509552

SCHEMBL20509552

COc1cc2nc(C)[nH]c(=O)c2cc1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.58
▸ CTSV O60911 2/20 0.55
▸ CTSL P07711 2/20 0.55
▸ PDE3B Q13370 1/20 0.54
▸ PDE3A Q14432 1/20 0.54
▸ TUBB4A P04350 1/20 0.53
▸ TUBB P07437 1/20 0.53
▸ TUBA3C P0DPH7 1/20 0.53
▸ TUBA1B P68363 1/20 0.53
▸ TUBA4A P68366 1/20 0.53
▸ TUBB4B P68371 1/20 0.53
▸ TUBB3 Q13509 1/20 0.53
▸ TUBB2A Q13885 1/20 0.53
▸ TUBB8 Q3ZCM7 1/20 0.53
▸ TUBA3E Q6PEY2 1/20 0.53
▸ TUBA1A Q71U36 1/20 0.53
▸ TUBA1C Q9BQE3 1/20 0.53
▸ TUBB6 Q9BUF5 1/20 0.53
▸ TUBB2B Q9BVA1 1/20 0.53
▸ TUBB1 Q9H4B7 1/20 0.53

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
SCHEMBL27041281 1.00 ELANE (0.58) ELANECTSVCTSLPDE3BPDE3A
SCHEMBL28945891 0.85 KDM4E (0.58) ELANECTSVCTSLPDE3BPDE3A
SCHEMBL6128121 0.83 KDM4E (0.62) PDE3BPDE3ATUBB4ATUBBTUBA3C
SCHEMBL28945909 0.81 KDM4E (0.53) ELANECTSVCTSLPDE3BPDE3A
SCHEMBL1013586 0.81 IP6K1 (0.62) ELANECTSVCTSLPDE3BPDE3A
SCHEMBL156504 0.81 IP6K1 (0.62) ELANECTSVCTSLPDE3BPDE3A
SCHEMBL29486901 0.80 SMN1; SMN2 (0.49) ELANECTSVCTSLPDE3BPDE3A
Hydrochloric Acid SCHEMBL27988350 0.80 IP6K1 (0.60) ELANECTSVCTSLPDE3BPDE3A
SCHEMBL873978 0.79 GUSB (0.60) ELANECTSVCTSLSMN1; SMN2MEN1
SCHEMBL11919210 0.78 GUSB (0.50) ELANECTSVCTSLPDE3BPDE3A

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-20240083857-A1 2-Methyl-Quinazolines Bayer Pharma AG (DE) 2024-03-14 — — US disclosed
WO-2022170917-A1 POLYCYCLIC PYRIMIDINE DERIVATIVE AS SOS1 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 苏州阿尔脉生物科技有限公司 2022-08-18 — — WO disclosed
US-20220235013-A1 2-METHYL-QUINAZOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-07-28 — — US disclosed
EP-3601267-A1 2-METHYL-QUINAZOLINES Bayer Pharma Aktiengesellschaft (DE) 2020-02-05 — — EP disclosed
WO-2018172250-A1 2-METHYL-QUINAZOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-09-27 — — 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-20240083857-A1 2-Methyl-Quinazolines NRAS, KRAS, KSR2 ELANE 3269/4885CTSV 3610/4885CTSL 4109/4885
US-20220235013-A1 2-METHYL-QUINAZOLINES NRAS, KRAS, KSR2 ELANE 3269/4885CTSV 3610/4885CTSL 4109/4885

“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.

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