SCHEMBL4604208

SCHEMBL4604208

Fc1cc(Cl)ccc1Cc1ccc(Cl)cc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
IDO1 P14902 3/20 0.48
HIF1A Q16665 2/20 0.48
CYP3A4 P08684 2/20 0.48
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
SLC22A1 O15245 1/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
HSP90AA1 P07900 1/20 0.48
HSPD1 P10809 1/20 0.48
HSPA5 P11021 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
CASP1 P29466 1/20 0.48
HTT P42858 1/20 0.48
BLM P54132 1/20 0.48
HSPE1 P61604 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL17664016 0.87 KMT2A (0.56) KMT2AIDO1HIF1ACYP3A4MEN1
SCHEMBL25236513 0.83 HTR2A (0.42) KMT2AIDO1HIF1ACYP3A4MEN1
SCHEMBL5330355 0.83 HTR2A (0.42) IDO1CYP3A4HTR2ATP53HTR1A
SCHEMBL269324 0.81 HTR2A (0.41) KMT2AIDO1HIF1ACYP3A4MEN1
SCHEMBL13908021 0.81 HTR2A (0.41) KMT2AIDO1HIF1ACYP3A4MEN1
Bromide SCHEMBL28745183 0.81 HTR2A (0.41) KMT2AIDO1HIF1ACYP3A4MEN1
SCHEMBL140474 0.81 HTR2A (0.45) KMT2AIDO1CYP3A4LMNAALDH1A1
SCHEMBL4331373 0.81 HTR2A (0.45) KMT2AIDO1CYP3A4ALDH1A1POLB
SCHEMBL17552702 0.81 HTR2A (0.41) KMT2AIDO1HIF1ACYP3A4MEN1
SCHEMBL134961 0.81 TP53 (0.41) KMT2AIDO1HIF1ACYP3A4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0895991-B1 Halogenating agent MITSUI CHEMICALS INC (JP) 2008-07-09 EP disclosed
US-6632949-B2 Difluoro-diamine methylene derivatives MITSUI CHEMICALS, INC. (JP) 2003-10-14 US disclosed
US-20030004348-A1 Halogenating agents SONODA HIROSHI (JP) 2003-01-02 US disclosed
US-6458990-B1 BIS(DIHYDROCARBYLAMINO)DIFLUOROMETHANE OR CYCLIC DERIVATIVES THEREOF; FORMING BY REACTING ALKALI METAL HALIDE WITH THE CORRESPONDING AMIDINIUM SALT; FLUORINATION OF ALCOHOLS, THIOPHENOLS, ALDEHYDES, AND KETONES MITSUI CHEMICALS, INC. (JP) 2002-10-01 US disclosed
US-20020042521-A1 Nitrogen-based halogenating agents and process for preparing halogen-containing compounds SONODA HIROSHI (JP) 2002-04-11 US disclosed
US-6329529-B1 FOR FLUORINATING OF ORGANIC COMPOUNDS, EFFICIENCY, POLLUTION CONTROL MITSUI CHEMICALS, INC. (JP) 2001-12-11 US disclosed
EP-0895991-A2 Halogenating agent Mitsui Chemicals, Inc. (JP) 1999-02-10 EP 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-20030004348-A1 Halogenating agents AFF1, NAF1, AFF2 KMT2A 1834/4885IDO1 2009/4885HIF1A 123/4885
US-20020042521-A1 Nitrogen-based halogenating agents and process for preparing halogen-containing compounds AFF1, NAF1, CYP2F1 KMT2A 2122/4885IDO1 1127/4885HIF1A 158/4885

“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.