SCHEMBL21910596

SCHEMBL21910596

Fc1ccc(C(c2ccc(F)cc2)N2CCNC(C3CC3)C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.42
ACHE P22303 3/20 0.40
CYP2D6 P10635 3/20 0.37
CYP19A1 P11511 1/20 0.37
POLB P06746 1/20 0.37
OPRM1 P35372 3/20 0.37
OPRD1 P41143 2/20 0.37
OPRK1 P41145 2/20 0.37
OPRL1 P41146 2/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
GRM2 Q14416 1/20 0.35
IGF1R P08069 1/20 0.35
SIGMAR1 Q99720 2/20 0.34
CACNA1B Q00975 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
MAPK1 P28482 1/20 0.34
THPO P40225 1/20 0.34

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
SCHEMBL7291110 0.81 HRH3 (0.43) HRH3ACHECYP2D6CYP19A1POLB
SCHEMBL7268681 0.81 HRH3 (0.43) HRH3ACHECYP2D6CYP19A1POLB
SCHEMBL7437112 0.80 HRH3 (0.58) HRH3ACHECYP2D6CYP19A1POLB
Water SCHEMBL7267183 0.80 HRH3 (0.43) HRH3ACHECYP2D6CYP19A1POLB
SCHEMBL14033487 0.77 HRH3 (0.44) HRH3ACHECYP2D6CYP19A1POLB
SCHEMBL26673752 0.75 HRH3 (0.46) HRH3ACHECYP2D6CYP19A1OPRM1
SCHEMBL21831282 0.75 HRH3 (0.43) HRH3ACHECYP2D6CYP19A1OPRM1
SCHEMBL27048103 0.75 HRH3 (0.43) HRH3ACHECYP2D6CYP19A1OPRM1
SCHEMBL27048362 0.75 HRH3 (0.43) HRH3ACHECYP2D6CYP19A1OPRM1
SCHEMBL21910240 0.74 CACNA2D1 (0.43) HRH3OPRM1OPRD1OPRK1OPRL1

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
CN-112654621-B Substituted naphthyridinone compounds useful as T cell activators 百时美施贵宝公司 2024-05-14 CN disclosed
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 US disclosed
CN-112654621-A Substituted naphthyridinone compounds useful as T cell activators 百时美施贵宝公司 2021-04-13 CN disclosed
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-23 US disclosed
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-02 US disclosed
US-20200109140-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS SYNGENE INTERNATIONAL LIMITED (IN) 2020-04-09 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 (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-20200109140-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG HRH3 741/4885ACHE 3866/4885CYP2D6 3712/4885
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG HRH3 741/4885ACHE 3866/4885CYP2D6 3712/4885
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG HRH3 741/4885ACHE 3866/4885CYP2D6 3712/4885
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG HRH3 741/4885ACHE 3866/4885CYP2D6 3712/4885

“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.