SCHEMBL27455200

SCHEMBL27455200

COc1cccc(CSC)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
MAPT P10636 2/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
IDO1 P14902 3/20 0.39
TAAR1 Q96RJ0 1/20 0.39
ALPL P05186 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL13791152 0.81 HTR2A (0.43) HTR2AHTR2CMAPTRAB9AKMT2A
SCHEMBL515180 0.80 IDO1 (0.53) MAPTALDH1A1L3MBTL1IDO1TAAR1
SCHEMBL18994627 0.79 CYP1A2 (0.51) HTR2AHTR2CKMT2AALDH1A1L3MBTL1
SCHEMBL8926 0.79 TAAR1 (0.52) HTR2AHTR2CMAPTALDH1A1L3MBTL1
SCHEMBL172225 0.79 HTR2A (0.46) HTR2AHTR2CMAPTL3MBTL1IDO1
SCHEMBL29792655 0.79 TAAR1 (0.52) HTR2AHTR2CMAPTALDH1A1L3MBTL1
SCHEMBL3906398 0.78 HTR2A (0.41) HTR2AHTR2CKMT2AALDH1A1L3MBTL1
SCHEMBL10870949 0.78 IDO1 (0.43) HTR2AMAPTRAB9AALDH1A1L3MBTL1
Bromide SCHEMBL15741709 0.77 TAAR1 (0.50) HTR2AHTR2CMAPTALDH1A1L3MBTL1
SCHEMBL422832 0.77 HTR2A (0.44) HTR2AHTR2CMAPTALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029739-B2 SHP2 inhibitor and use thereof KANAPH THERAPEUTICS INC. (KR) 2024-07-09 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 (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-12029739-B2 SHP2 inhibitor and use thereof PTPN1, PTPN5, PTPN2 HTR2A 4330/4885HTR2C 4638/4885MAPT 3027/4885

“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.