SCHEMBL23013221

SCHEMBL23013221

Cc1nc(NC(C)C)ccc1Br

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.44
▸ NPC1 O15118 8/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ LMNA P02545 1/20 0.42
▸ KMT2A Q03164 3/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ PDE10A Q9Y233 1/20 0.39
▸ TRPM8 Q7Z2W7 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ EDNRA P25101 1/20 0.37
▸ HCAR3 P49019 1/20 0.36

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
SCHEMBL25150667 0.79 NOS3 (0.41) ALDH1A1KMT2APDE10ATRPM8KDM4E
SCHEMBL29514007 0.77 RAB9A (0.47) RAB9ANPC1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL25345367 0.77 RAB9A (0.47) RAB9ANPC1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL30639753 0.77 GPR55 (0.47) —
SCHEMBL23023572 0.76 PDE10A (0.39) ALDH1A1LMNAKMT2APDE10ATRPM8
SCHEMBL31200409 0.75 RAB9A (0.46) RAB9ANPC1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL4204986 0.75 RAB9A (0.46) RAB9ANPC1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL16991362 0.73 RAB9A (0.43) RAB9ANPC1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL15509231 0.73 RAB9A (0.43) RAB9ANPC1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL18053161 0.72 IDH1 (0.48) ALDH1A1MAPK1LMNAHSD17B10PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12227507-B2 Pharmaceutical compounds PFIZER INC. (US) 2025-02-18 — — US disclosed
CN-114555604-B Pharmaceutical compounds 辉瑞公司 2024-11-15 — — CN disclosed
CN-116075516-A Benzodiazepine derivatives useful for the treatment of respiratory syncytial virus infection 辉瑞大药厂 2023-05-05 — — CN disclosed
US-11634425-B2 Pharmaceutical compounds PFIZER INC. (US) 2023-04-25 — — US disclosed
US-11634425-B2 Pharmaceutical compounds PFIZER INC. (US) 2023-04-25 — — US disclosed
US-20220324873-A1 PHARMACEUTICAL COMPOUNDS PFIZER INC. 2022-10-13 — — US disclosed
US-20220306639-A1 PHARMACEUTICAL COMPOUNDS PFIZER INC. 2022-09-29 — — US disclosed
EP-4017856-A1 PHARMACEUTICAL COMPOUNDS Reviral Limited (GB) 2022-06-29 — — EP disclosed
CN-114555604-A Pharmaceutical compounds 瑞威有限公司 2022-05-27 — — CN disclosed
WO-2021032992-A1 PHARMACEUTICAL COMPOUNDS ReViral Limited (GB) 2021-02-25 — — WO disclosed
WO-2021032992-A1 PHARMACEUTICAL COMPOUNDS ReViral Limited (GB) 2021-02-25 — — 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 (4 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-12227507-B2 Pharmaceutical compounds CHRNA6, GABRA6, CHRNA7 RAB9A 1472/4885NPC1 484/4885ALDH1A1 3480/4885
US-11634425-B2 Pharmaceutical compounds GABRA6, CHRNA6, CNR1 RAB9A 1284/4885NPC1 605/4885ALDH1A1 3010/4885
US-20220306639-A1 PHARMACEUTICAL COMPOUNDS CHRNA6, GABRA6, CHRNA7 RAB9A 1472/4885NPC1 484/4885ALDH1A1 3480/4885
US-20220324873-A1 PHARMACEUTICAL COMPOUNDS GABRA6, CNR1, CHRNA6 RAB9A 1147/4885NPC1 547/4885ALDH1A1 3112/4885

“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.

Send feedback