SCHEMBL8277482

SCHEMBL8277482

Cc1nc2c(n1C)CCN(C)C2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 6/20 0.38
CD274 Q9NZQ7 6/20 0.38
CYP2C19 P33261 3/20 0.37
HRH3 Q9Y5N1 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
CYP2C9 P11712 1/20 0.30
P2RX7 Q99572 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL1159646 0.84 CYP2C19 (0.41) CYP2C19HRH3CYP1A2CYP2D6MAOA
SCHEMBL17380643 0.83 HDAC1 (0.33)
SCHEMBL21620980 0.81
SCHEMBL28475541 0.78 PDCD1 (0.38) PDCD1CD274CYP2C19HRH3CYP1A2
SCHEMBL21552766 0.78
SCHEMBL22823844 0.76 CNR2 (0.39) PDCD1CD274CYP2C19HRH3CYP1A2
SCHEMBL1106421 0.76 PDCD1 (0.36) PDCD1CD274CYP2C19HRH3CYP1A2
SCHEMBL23374970 0.75 CCR5 (0.42) P2RX7
SCHEMBL23374984 0.75 CNR2 (0.34) PDCD1CD274HRH3
SCHEMBL23374969 0.75 PDCD1 (0.46) PDCD1CD274CYP2C19HRH3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4223369-A1 IMMUNOMODULATOR COMPOUNDS AND METHODS OF USE Incyte Corporation (US) 2023-08-09 EP disclosed
WO-2022169755-A1 SULFONAMIDE SUBSTITUTED N-(1H-INDOL-7-YL) BENZENESULFONAMIDES AND USES THEREOF TRIANA BIOMEDICINES, INC. (US) 2022-08-11 WO disclosed
WO-2021093817-A1 IMMUNOMODULATORY COMPOUNDS, COMPOSITION AND APPLICATION THEREOF 杭州和正医药有限公司 2021-05-20 WO disclosed
WO-2018119224-A1 TETRAHYDRO IMIDAZO[4,5-C]PYRIDINE DERIVATIVES AS PD-L1 INTERNALIZATION INDUCERS INCYTE CORPORATION (US) 2018-06-28 WO disclosed
WO-2018119266-A1 BENZOOXAZOLE DERIVATIVES AS IMMUNOMODULATORS INCYTE CORPORATION (US) 2018-06-28 WO disclosed
WO-2018119286-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION (US) 2018-06-28 WO disclosed
US-8895544-B2 Indazoles PFIZER LIMITED (GB) 2014-11-25 US disclosed
US-20140024634-A1 INDAZOLES PFIZER LIMITED (GB) 2014-01-23 US disclosed
US-8575336-B2 Indazoles PFIZER LIMITED (GB) 2013-11-05 US disclosed
US-20130029968-A1 INDAZOLES PFIZER LIMITED (GB) 2013-01-31 US disclosed
US-8153670-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-04-10 US disclosed
US-20090298806-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2009-12-03 US disclosed
US-7521470-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-21 US disclosed
WO-2006002099-A2 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-01-05 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 (3 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-20130029968-A1 INDAZOLES CYP11B2, CYP11B1, IL33 PDCD1 3794/4885CD274 4268/4885CYP2C19 12/4885
US-20090298806-A1 FACTOR XA INHIBITORS TFPI, F12, F11 PDCD1 4043/4885CD274 4299/4885CYP2C19 75/4885
US-20140024634-A1 INDAZOLES JAK1, JAK3, JAK2 PDCD1 920/4885CD274 1901/4885CYP2C19 125/4885

“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.