SCHEMBL21046989

SCHEMBL21046989

C[Si](C)(C)C#Cc1cccc(N)c1F

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 2/20 0.36
MAPT P10636 2/20 0.36
CYP2C9 P11712 2/20 0.36
HPGD P15428 2/20 0.36
CYP2C19 P33261 2/20 0.36
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TSHR P16473 2/20 0.36
CYP2D6 P10635 1/20 0.36
CREBBP Q92793 1/20 0.35
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PIK3CA P42336 1/20 0.32

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
SCHEMBL29350654 0.83 KDM4E (0.30) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL20929171 0.83 KDM4E (0.30) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL31736077 0.81 KDM4E (0.37) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL3150946 0.80 CYP3A4 (0.52) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL1507410 0.79 CYP3A4 (0.48) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL15689490 0.75 CREBBP (0.36) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL28815369 0.74 ALDH1A1 (0.48) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL28422107 0.74 ERN1 (0.37) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL14992925 0.74 PTGDR2 (0.42) CYP3A4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL21132629 0.73 KMT2A (0.35) CYP3A4KDM4EMEN1ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250282752-A1 Quinazoline Derivative Salt Crystal Form, Preparation Method and Application WEISHANG (SHANGHAI) BIO-PHARMACEUTICAL CO., LTD. (CN) 2025-09-11 US disclosed
US-12371415-B2 Quinazoline derivative salt crystal form, preparation method and application WEISHANG (SHANGHAI) BIO-PHARMACEUTICAL CO., LTD. (CN) 2025-07-29 US disclosed
EP-3498693-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2024-10-30 EP disclosed
US-20240025874-A1 Quinazoline Derivative Salt Crystal Form, Preparation Method and Application Wayshire Biopharm Holding Limited (US) 2024-01-25 US disclosed
WO-2022266458-A1 6-HETEROCYCLOALKYL-QUINAZOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 WO disclosed
CN-109790122-B Heterocyclic compounds 武田药品工业株式会社 2022-06-24 CN disclosed
US-10696651-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-06-30 US disclosed
WO-2019196619-A1 QUINAZOLINE DERIVATIVE SALT-FORM CRYSTAL FORM, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 威尚(上海)生物医药有限公司 2019-10-17 WO disclosed
EP-3498693-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2019-06-19 EP disclosed
US-20190169166-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-06-06 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-10696651-B2 Heterocyclic compound EIF2AK4, GCN1, GTF2I CYP3A4 4156/4885KDM4E 4285/4885MEN1 415/4885
US-12371415-B2 Quinazoline derivative salt crystal form, preparation method and application H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SDHA, FH CYP3A4 826/4885KDM4E 1478/4885MEN1 114/4885
US-20240025874-A1 Quinazoline Derivative Salt Crystal Form, Preparation Method and Application H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SDHA, FH CYP3A4 826/4885KDM4E 1478/4885MEN1 114/4885
US-20190169166-A1 HETEROCYCLIC COMPOUND EIF2AK4, GCN1, GTF2I CYP3A4 4156/4885KDM4E 4285/4885MEN1 415/4885
US-20250282752-A1 Quinazoline Derivative Salt Crystal Form, Preparation Method and Application H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SDHA, FH CYP3A4 826/4885KDM4E 1478/4885MEN1 114/4885

“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.