SCHEMBL3589255

SCHEMBL3589255

CCCCCC(C)N1CCN(C)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 1/20 0.39
OPRM1 P35372 1/20 0.38
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 1/20 0.35
MC4R P32245 2/20 0.33
CA1 P00915 2/20 0.32
SPHK1 Q9NYA1 1/20 0.32
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TP53 P04637 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.32
MCL1 Q07820 1/20 0.32
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 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
SCHEMBL19481207 0.98 GNAI3 (0.38) KDM2BOPRM1GNAI3GNAO1GNAI1
SCHEMBL19101360 0.98 GNAI3 (0.38) KDM2BOPRM1GNAI3GNAO1GNAI1
SCHEMBL803602 0.94 KDM2B (0.39) KDM2BOPRM1GNAI3GNAO1GNAI1
SCHEMBL21499827 0.93 KDM2B (0.36) KDM2BOPRM1GNAI3GNAO1GNAI1
SCHEMBL9070252 0.91 OPRM1 (0.44) KDM2BOPRM1CA1SPHK1LMNA
SCHEMBL20283927 0.91 KDM2B (0.35) KDM2BOPRM1GNAI3GNAO1GNAI1
SCHEMBL11870424 0.89 OPRM1 (0.42) KDM2BOPRM1SPHK1LMNATSHR
SCHEMBL3411263 0.89 OPRM1 (0.42) KDM2BOPRM1SPHK1LMNATSHR
SCHEMBL13881902 0.85 MC4R (0.36) OPRM1MC4RKDM4ETSHRMCL1
SCHEMBL28122630 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210230538-A1 USES OF KINASE INHIBITORS FOR INDUCING AND MAINTAINING PLURIPOTENCY WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2021-07-29 US disclosed
US-20100029636-A1 Lck inhibitors NOVARTIS AG (CH) 2010-02-04 US disclosed
CN-101516888-A Pyrazolo [1, 5-a] pyrimidine derivatives and their therapeutic use NOVARTIS AG (CH) 2009-08-26 CN 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 (1 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-20100029636-A1 Lck inhibitors LCK, ZAP70, FYN KDM2B 821/4885OPRM1 4156/4885GNAI3 858/4885

“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.