SCHEMBL24733236

SCHEMBL24733236

CC(C)N1CCC=C(F)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.41
HRH3 Q9Y5N1 3/20 0.37
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
CYP2D6 P10635 1/20 0.32
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
ALOX15 P16050 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
HRH4 Q9H3N8 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
SCHEMBL24733235 0.81 KDM4E (0.41) CHRNA7HRH3KDM4ECYP2D6NPC1
SCHEMBL24733231 0.81
SCHEMBL10211089 0.77 CHRNA7 (0.42) CHRNA7HRH3KDM4EALDH1A1MAPT
SCHEMBL839986 0.75 CHRNA7 (0.41) CHRNA7HRH3KDM4EALDH1A1MAPT
SCHEMBL16992195 0.72 CHRNA7 (0.50) CHRNA7HRH3KDM4EALDH1A1MAPT
SCHEMBL22648304 0.72 CHRNA7 (0.38) CHRNA7HRH3KDM4EALDH1A1MAPT
SCHEMBL21413941 0.71 CHRNA7 (0.37) CHRNA7HRH3KDM4EALDH1A1MAPT
SCHEMBL24743223 0.69 CHRNA7 (0.36) CHRNA7HRH3
SCHEMBL20621759 0.69 CHRNA7 (0.36) CHRNA7HRH3
SCHEMBL19998539 0.69 HRH3 (0.55) CHRNA7HRH3KDM4ECYP2D6NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
US-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
WO-2023230190-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2023-11-30 WO disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 US disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 US disclosed
WO-2023154766-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2023-08-17 WO disclosed
WO-2023114733-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2023-06-22 WO disclosed
WO-2022256459-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2022-12-08 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 (2 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-20230374042-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS CHRNA7 4728/4885HRH3 2573/4885KDM4E 4616/4885
US-11912723-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS CHRNA7 4728/4885HRH3 2573/4885KDM4E 4616/4885

“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.